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Improved Stability of Aspergillus oryzae α-Amylase Immobilized on Polyaniline Tin Oxide Nanocomposites 提高固定在聚苯胺氧化锡纳米复合材料上的黑曲霉α-淀粉酶的稳定性
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-13 DOI: 10.2174/0113852728295467240219051245
Mohd Jahir Khan, Abrar Ahmad
: In the present study, an immobilization support, Polyaniline tin oxide nanocomposite (PANI-SnO2- NC) was synthesized by in situ polymerization of aniline and ammonium peroxydisulphate. The prepared nanocomposite was characterized by various state-of-the-art techniques. The average size of native SnO2-NPs and PANI-SnO2-NC was 65±19 nm and 93±15 nm, respectively. An important industrial enzyme, α-amylase from Aspergillus oryzae was immobilized on PANI-SnO2-NC, which retained 87% enzyme activity. The improved stability of the immobilized enzyme was noticed against pH and temperature, as it retained 65% activity at 60 °C while the free enzyme exhibited 41% activity under similar experimental conditions. Moreover, PANI-SnO2- NC-immobilized α-amylase produced starch (26.42 mg mL–1) more efficiently than free enzyme (20.90 mg mL– 1) after 8 h in batch hydrolysis. PANI-SnO2-NC-bound α-amylase exhibited 54% activity after eight repeated uses. Molecular docking analysis of α-amylase with PANI suggested the ligand binding site to be located quite far away from the active site of the enzyme.
:本研究通过苯胺和过氧化二硫酸铵的原位聚合合成了一种固定化支持物--聚苯胺氧化锡纳米复合材料(PANI-SnO2- NC)。所制备的纳米复合材料通过各种最先进的技术进行了表征。原生 SnO2-NPs 和 PANI-SnO2-NC 的平均尺寸分别为 65±19 nm 和 93±15 nm。在 PANI-SnO2-NC 上固定了一种重要的工业酶,即来自黑曲霉的 α 淀粉酶,其酶活性保持率为 87%。固定化酶在 pH 值和温度条件下的稳定性得到了提高,在 60 °C 的条件下,固定化酶保持了 65% 的活性,而游离酶在类似的实验条件下只有 41% 的活性。此外,批量水解 8 小时后,PANI-SnO2-NC-固定化α-淀粉酶产生淀粉(26.42 毫克毫升/升-1)的效率高于游离酶(20.90 毫克毫升毫升-1)。重复使用八次后,PANI-SnO2-NC 结合的 α 淀粉酶显示出 54% 的活性。α-淀粉酶与 PANI 的分子对接分析表明,配体结合位点距离酶的活性位点相当远。
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引用次数: 0
Syntheses and Spectroscopic Characterization of Selected Methyl Quinolinylphosphonic and Quinolinylphosphinic Acids; Rationalized Based on DFT calculation 精选甲基喹啉基膦酸和喹啉基膦酸的合成与光谱特性;基于 DFT 计算的合理化分析
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-09 DOI: 10.2174/0113852728292818240301052024
Jacek E. Nycz, Nataliya Karaush-Karmazin, Boris Minaev, Valentina Minaeva, Jan G. Małecki, Maria Książek, Daniel Swoboda, Joachim Kusz
: The quinoline derivatives arouse interest due to their broad spectrum of activity. The phosphorus compounds under investigation, quinolinylphosphonic and -phosphinic acids and aminophenylphosphonic and -phosphinic acids, possess potent bioactive properties, mimicking amino acids, phosphate esters, anhydrides, or carboxylate groups in enzymes. Despite its potential value, there is no reported example of quinolinylphosphonic or - phosphinic acids with phosphonic or phosphinic functional groups connected directly to the benzene ring in quinoline constitution. The selected quinoline derivatives have been synthesized by adopting the Skraup-Doebner-Von Miller reaction. To this end, the syntheses of aminophenylphosphonic and -phosphinic acids were conducted and afforded the target products with high yield. All structures have been proven by the combination of NMR, IR, MS, and HRMS techniques and were rationalized based on DFT calculation. The structures of triphenylphosphane oxide (TPO), diphenylphosphosphinic acid (1c), (tert-butyl)phenylphosphinic acid (1d) and bis(3-nitrophenyl)phosphinic acid (2c) were determined by single-crystal X-ray diffraction measurements. The Hirshfeld surface analyses for 1c, 1d and 2c were performed to analyze the intermolecular interactions in their crystal structures. Rephrase: According to our findings, the presence of numerous intermolecular PO•••H, NO•••H, and CH•••O contacts stabilizes the crystal structures. The NO•••H interactions manifest in the IR spectrum of 2c crystal as a narrow band with a maximum at 3088 cm-1. The PO•••H intermolecular interactions are attributed to a weak experimental band at 1288 cm-1. background: The quinoline derivatives arouse interest due to their broad spectrum of activity. The phosphorus compounds under investigation, such as quinolinylphosphonic or quinolinylphosphinic acids, aminophenylphosphonic or aminophenylphosphinic acids aminophenylphosphonic or aminophenylphosphinic acids, possess potent properties bioactive properties, mimicking amino acids, phosphate esters, anhydrides, or carboxylate groups in enzymes. Despite its potential value, there is no reported example of quinolinylphosphonic and quinolinylphosphinic acids with phosphonic and phosphinic functional groups directly connected to the benzene ring in quinoline constitution to the best of our knowledge, according to literature data. objective: Syntheses and spectroscopic characterization of selected methyl quinolinylphosphonic and quinolinylphosphinic acids, rationalized based on DFT calculation method: All the structures have been proven by the combination of NMR, IR, MS, and HRMS and rationalized based on DFT calculation. The structures of triphenylphosphane oxide (TPO), diphenylphosphosphinic acid (1c), (tert-butyl)phenylphosphinic acid (1d) and bis(3-nitrophenyl)phosphinic acid (2c) were determined by single-crystal X-ray diffraction measurements.
:喹啉衍生物因其广泛的活性而引起人们的兴趣。正在研究的磷化合物,即喹啉基膦酸和-膦酸以及氨基苯基膦酸和-膦酸,具有很强的生物活性,可模拟酶中的氨基酸、磷酸酯、酸酐或羧基。尽管喹啉基膦酸或-膦酸具有潜在的价值,但目前还没有关于其膦酸或膦酸官能团直接与喹啉结构中的苯环相连的实例报道。所选的喹啉衍生物是通过 Skraup-Doebner-Von Miller 反应合成的。为此,进行了氨基苯基膦酸和-膦酸的合成,并以高产率得到了目标产物。所有结构都已通过核磁共振、红外光谱、质谱和 HRMS 技术的结合得到证实,并在 DFT 计算的基础上得到了合理的解释。通过单晶 X 射线衍射测量确定了三苯基氧化膦(TPO)、二苯基膦酸(1c)、(叔丁基)苯基膦酸(1d)和双(3-硝基苯基)膦酸(2c)的结构。对 1c、1d 和 2c 进行了 Hirshfeld 表面分析,以分析其晶体结构中的分子间相互作用。改写:根据我们的研究结果,大量分子间 PO--H、NO--H 和 CH-O 接触的存在稳定了晶体结构。在 2c 晶体的红外光谱中,NO--H 相互作用表现为一条窄带,最大值在 3088 cm-1 处。PO--H分子间的相互作用产生于1288 cm-1处的微弱实验带:喹啉衍生物因其广泛的活性谱而引起人们的兴趣。正在研究的磷化合物,如喹啉基膦酸或喹啉基膦酸、氨基苯基膦酸或氨基苯基膦酸、氨基苯基膦酸或氨基苯基膦酸,具有强大的生物活性特性,可模拟酶中的氨基酸、磷酸酯、酸酐或羧基。尽管喹啉基膦酸和喹啉基膦酸具有潜在的价值,但就我们所知,根据文献资料,还没有报道过喹啉基膦酸和喹啉基膦酸的膦酸官能团直接连接到喹啉结构中的苯环上:根据 DFT 计算方法,对选定的甲基喹啉基膦酸和喹啉基膦酸进行合成和光谱鉴定:通过核磁共振、红外光谱、质谱和 HRMS 的综合分析,证明了所有的结构,并基于 DFT 计算对其进行了合理化。通过单晶 X 射线衍射测量确定了三苯基氧化膦(TPO)、二苯基膦酸(1c)、(叔丁基)苯基膦酸(1d)和双(3-硝基苯基)膦酸(2c)的结构。
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引用次数: 0
Synthesis, Structure, and Antimicrobial Properties of New Cobalt(II) Complexes with 1-Propargylimidazoles 1-Propargylimidazoles 的新钴(II)配合物的合成、结构和抗菌特性
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-09 DOI: 10.2174/0113852728295396240314054651
Irina V. Sterkhova, Lidiya N. Parshina, Lyudmila A. Grishchenko, Tatyana N. Borodina, Lyudmila A. Belovezhets, Valentin A. Semenov
: Complexes of cobalt(II) chloride with 1-propargylimidazole, 1-propargyl-2-methylimidazole, and 1- propargylbenzimidazole ligands were synthesized and studied by FTIR spectroscopy and X-ray analysis. According to the X-ray analysis, the crystal molecules of compounds were connected by non-covalent interactions, such as halogen bonds and π-stacking. The nature and energy of coordination metal-ligand and noncovalent bonds for structures under study were estimated in the frame of QTAIM (Quantum Theory “Atoms In Molecules”). The antimicrobial activity of obtained cobalt(II) chloride complexes was evaluated in relation to microorganisms, E. durans, B. subtilis, and E. coli. Complexes of 1-propargyl-2-methylimidazole and 1- propargylbenzimidazole with cobalt(II) chloride demonstrated high activity against E. coli and E. durans relatively and could be recommended as antimicrobial drugs.
:合成了氯化钴(II)与 1-丙炔基咪唑、1-丙炔基-2-甲基咪唑和 1-丙炔基苯并咪唑配体的配合物,并通过傅立叶变换红外光谱和 X 射线分析进行了研究。根据 X 射线分析,化合物的晶体分子通过卤素键和π堆叠等非共价相互作用连接在一起。在 QTAIM("原子在分子中 "量子理论)的框架内,对所研究结构的金属配位键和非共价键的性质和能量进行了估算。对所获得的氯化钴(II)络合物的抗菌活性进行了评估,这些络合物与微生物(杜氏大肠杆菌、枯草杆菌和大肠杆菌)有关。1- 丙炔基-2-甲基咪唑和 1- 丙炔基苯并咪唑与氯化钴(II)的络合物对大肠杆菌和杜兰氏菌表现出较高的活性,可推荐用作抗菌药物。
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引用次数: 0
Synthesis and In-Silico Studies of Ortho-Fluorinated Benzenesulfonamides as Putative Anti-CETP Agents 作为拟抗 CETP 药物的正氟化苯磺酰胺的合成和室内研究
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-09 DOI: 10.2174/0113852728295939240315040152
Reema Abu Khalaf, Lama Jaradat, Maha Habash
: Cardiovascular disease is one of the primary causes of death. Atherosclerosis produces artery constriction or obstruction, which can lead to a heart attack or stroke. Cholesteryl Ester Transfer Protein (CETP) is a protein that aids in reverse cholesterol transport. It promotes cholesteryl ester transfer from HDL to LDL and VLDL. So, inhibition of CETP by drugs limits cardiovascular disease by decreasing LDL and increasing HDL cholesterol. In this study, ten ortho-fluoro substituted benzenesulfonamides 6a-6j were prepared, and their structure was fully determined using 1H NMR, 13C NMR, HR-MS, and IR. In vitro biological evaluation showed that compound 6d has the highest inhibitory activity with 100% inhibition, while compounds 6a-6c and 6e-6j had activities ranged from 29% - 83% at 10 μM concentration. Interestingly, para-substituted derivatives (6d, 6g, and 6j) were observed to have greater CETP inhibitory activities than their ortho- and meta- analogues irrespective to the nature of substituent, i.e., CH3, Cl, or NO2. Ligandfit docking experiment revealed the difference in the binding mode among the synthesized compounds, which is reflected in their CETP inhibitory activity. background: Cardiovascular disease is one of the primary causes of death. Atherosclerosis produces artery constriction or obstruction, which can lead to a heart attack or stroke. Cholesteryl ester transfer protein (CETP) is a protein that aids in reverse cholesterol transport. It promotes cholesteryl ester transfer from HDL to LDL and VLDL. So, inhibition of CETP by drugs limits cardiovascular disease by decreasing LDL and increasing HDL cholesterol. method: and their structure was fully determined using 1H-NMR, 13C-NMR, HR-MS, and IR. conclusion: Ligandfit docking experiment revealed the difference in the binding mode among the synthesized compounds which is reflected on their CETP inhibitory activity.
:心血管疾病是导致死亡的主要原因之一。动脉粥样硬化会造成动脉收缩或阻塞,从而导致心脏病发作或中风。胆固醇酯转移蛋白(CETP)是一种有助于胆固醇逆向运输的蛋白质。它能促进胆固醇酯从高密度脂蛋白转移到低密度脂蛋白和超低密度脂蛋白。因此,通过药物抑制 CETP 可以减少低密度脂蛋白,增加高密度脂蛋白胆固醇,从而限制心血管疾病的发生。本研究制备了 10 个正氟取代的苯磺酰胺类化合物 6a-6j,并使用 1H NMR、13C NMR、HR-MS 和 IR 全面测定了它们的结构。体外生物学评价结果表明,化合物 6d 的抑制活性最高,抑制率达 100%,而化合物 6a-6c 和 6e-6j 在 10 μM 浓度下的活性为 29% - 83%。有趣的是,对位取代衍生物(6d、6g 和 6j)的 CETP 抑制活性高于其正交和偏交类似物,而与取代基的性质(即 CH3、Cl 或 NO2)无关。Ligandfit docking 实验揭示了合成化合物在结合模式上的差异,这反映在它们的 CETP 抑制活性上:心血管疾病是导致死亡的主要原因之一。动脉粥样硬化会造成动脉收缩或阻塞,从而导致心脏病发作或中风。胆固醇酯转移蛋白(CETP)是一种有助于胆固醇逆向运输的蛋白质。它能促进胆固醇酯从高密度脂蛋白转移到低密度脂蛋白和超低密度脂蛋白。因此,通过药物抑制 CETP 可降低低密度脂蛋白胆固醇,增加高密度脂蛋白胆固醇,从而限制心血管疾病的发生。 方法:使用 1H-NMR、13C-NMR、HR-MS 和 IR 全面测定了它们的结构:Ligandfit docking 实验表明,合成的化合物之间的结合模式存在差异,这反映在它们对 CETP 的抑制活性上。
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引用次数: 0
λ3-Iodane-Mediated Umpolung of Ketone and Enolate to Enolonium λ3-碘烷介导的酮和烯醇到烯醇鎓的乌普隆效应
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-05 DOI: 10.2174/0113852728302831240315064301
K. Parida
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引用次数: 0
Exploring Synthesis and Medicinal Applications of Andrographolide Derivatives: A Review 穿心莲内酯衍生物的合成与药物应用探索:综述
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-04 DOI: 10.2174/0113852728296785240308054135
Tanzeela Qadir, Shoaib Shaikh, Saadat A. Kanth, Jyotika Singh, Maria Baby, Praveen Kumar Sharma
: Andrographolide, derived from the plant Andrographis paniculata (AP), exhibits a diverse range of biological activities, encompassing anti-bacterial, anti-tumor, anti-inflammatory, anti-obesity, anti-viral, antifibrotic, hypoglycemic, and immunomodulatory properties. Notably, numerous analogs of andrographolide have been synthesized, incorporating significant chemical structural modifications to enhance bioavailability and druggability. A comprehensive exploration into their molecular and cellular mechanisms of action has also been undertaken, enriching our understanding. The investigation highlights the potential of related terpenoid analogs from Andrographis paniculata, beyond the diterpene lactone andrographolide, to hold promise in disease treatment due to structural similarities and diverse pharmacological effects. This review offers insights into the anticipated synthesis and therapeutic applications of andrographolide derivatives across a spectrum of disorders.
:穿心莲内酯提取自穿心莲(AP),具有多种生物活性,包括抗菌、抗肿瘤、抗炎、抗肥胖、抗病毒、抗纤维化、降血糖和免疫调节特性。值得注意的是,人们合成了许多穿心莲内酯类似物,对其化学结构进行了重大调整,以提高生物利用度和可药用性。此外,还对其分子和细胞作用机制进行了全面探索,丰富了我们的认识。这项研究强调了穿心莲中除二萜内酯穿心莲内酯以外的相关萜类类似物在疾病治疗方面的潜力,这些类似物具有结构相似性和不同的药理作用。本综述深入探讨了穿心莲内酯衍生物在各种疾病中的预期合成和治疗应用。
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引用次数: 0
Palladium-charcoal Catalyzed Direct Esterification of Aldehydes to Esters by NaIO4 钯炭催化 NaIO4 将醛直接酯化成酯
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-04 DOI: 10.2174/0113852728300082240308163721
Md. Mohinuddin, Kajol Ahmed, Izarul Islam, Anamul Hossain, Harendra N. Roy
:: An efficient direct oxidation method was developed to oxidize some aromatic and aliphatic aldehydes to esters by the dual utilization of NaIO4 and Pd-C. At ambient conditions, various aldehydes were employed in a clean esterification reaction to afford numerous esters in good to excellent yields. By this adopted method, some multifunctional aldehydes, high-energy-containing aromatic and unsaturated aldehydes, were advantageously oxidized to esters without noticeable difficulties. Moreover, no over-oxidation occurred to alcohols, and most byproducts were not formed during this oxidation process. Conventional and some modern methods lag behind owing to their easier operability and easy work-up process. This investigation has proven that the required oxidant (NaIO4) or catalyst (Pd-C) is useless to employ in excess, although some current methods utilize hugely expensive reagents for such conversions. Mundane reaction set-up, easy product recovery technique, non-toxic catalyst, and cheap and available starting materials are the noteworthy advantages of this method.
::研究人员开发了一种高效的直接氧化法,通过同时使用 NaIO4 和 Pd-C,将一些芳香族和脂肪族醛氧化成酯。在常温条件下,利用各种醛进行清洁的酯化反应,以良好至极佳的收率获得了多种酯。通过这种方法,一些多功能醛、高能量芳香族醛和不饱和醛被有效地氧化成酯,而不会出现明显的困难。此外,在此氧化过程中不会出现过度氧化成醇的情况,也不会产生大多数副产品。传统方法和一些现代方法之所以落后,是因为它们更易于操作,工作过程更简便。这项研究证明,过量使用所需的氧化剂(NaIO4)或催化剂(Pd-C)是没有用的,尽管目前的一些方法使用昂贵的试剂进行此类转化。这种方法的显著优点是:反应设置简单、产品回收技术容易、催化剂无毒、起始材料便宜易得。
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引用次数: 0
Synthesis of Aromatic Azides using Different Methodologies 使用不同方法合成芳香族叠氮化物
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-03 DOI: 10.2174/0113852728301737240307111549
Elisa Leyva, Silvia E. Loredo-Carrillo
:: For several decades, aromatic azides have been applied in diverse areas of research like synthesis of organic compounds, novel materials and photoaffinity labeling of biomolecules. The discovery of click chemistry and bioorthogonal chemistry expanded their applications. Currently, they are extensively used in biology, biochemistry and medicine. For many years, aromatic azides were usually prepared using nucleophilic substitution. In this classical procedure, commercially available anilines are first converted into aryl diazonium salts which in turn are transformed into aromatic azides by nucleophilic substitution with sodium azide. However, this procedure is rather inconvenient experimentally since it requires the use of strong acids and low temperatures. In recent years, several alternative procedures have been developed. In the present review, we present the synthesis of aromatic azides by means of different experimental methodologies.
::几十年来,芳香叠氮化物一直被应用于有机化合物的合成、新型材料和生物大分子的光亲和标记等多个研究领域。点击化学和生物正交化学的发现扩大了它们的应用范围。目前,它们被广泛应用于生物学、生物化学和医学领域。多年来,芳香叠氮化物通常采用亲核取代法制备。在这一经典程序中,市售苯胺首先被转化为芳基重氮盐,然后通过与叠氮化钠的亲核取代作用转化为芳香叠氮化物。然而,这一过程需要使用强酸和低温,因此在实验上非常不便。近年来,人们开发出了几种替代程序。在本综述中,我们介绍了通过不同实验方法合成芳香叠氮化物的过程。
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引用次数: 0
A Review on the Development of Polymer Supported Heterogeneous Palladium Materials for Organic Synthesis and Electrochemical Applications 聚合物支撑的异质钯材料在有机合成和电化学应用中的发展综述
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-02 DOI: 10.2174/0113852728299173240302041524
Ashlesha P. Kawale, Nishant Shekhar, Arti Srivastava, Subhash Banerjee
:: This comprehensive review explores the advancements in catalytic transformation, focusing on the use of heterogeneous catalytic systems with a particular emphasis on polymeric-supported palladium (Pd) complexes. This study explores the limitations associated with conventional homogeneous reagents, emphasizes the transition to eco-friendly catalytic systems, and emphasizes the importance of Pd nanoparticles. These nanoparticles are particularly noteworthy for their distinctive properties, including elevated catalytic activity, making them promising for various applications in organic synthesis. The review thoroughly examines the design and synthesis of heterogeneous catalysts, emphasizing the crucial selection of safe and recyclable supports to augment the longevity and reusability of metallic catalysts. Diverse polymer varieties, including polystyrene (PS), polyethylene (PE), polyacrylate derivatives, polyethylene glycol (PEG), and grafted polymers, are investigated as viable supports for Pd complexes. The authors intricately describe the synthesis techniques for these polymer-supported Pd catalysts and furnish illustrative examples showcasing their effectiveness in organic transformation. This comprehensive review additionally highlights the synthesis of polymer-supported palladium (Pd) materials and discusses their applications in electrochemistry. The focus extends to the electrocatalytic properties of Pdbased polymeric nanomaterials, showcasing their effectiveness in glucose sensing, hydrogen peroxide detection, and the sensing of other biological analytes. Furthermore, the catalytic capabilities of Pd nanoparticles in various electrochemical applications, including wastewater treatment and electrochemical capacitors, are explored. Integrating polymer-supported Pd materials into these electrochemical processes underscores their versatility and potential contributions to advancements in catalysis and electrochemical sensing. Catalytic applications featuring polymer-supported palladium complexes with polymeric ligands in organic synthesis processes use the Sonogashira reaction, Suzuki-Miyaura coupling, Heck reaction, Catalytic asymmetric transformations, etc. The subsequent section of the paper focuses on the creation of polymeric palladium complexes, achieved by the complexation of polymeric ligands with palladium precursors. It delves into noteworthy examples of catalytic processes employing polymer-supported palladium complexes featuring polymeric ligands, emphasizing distinct polymers, such as PS, PE, polyacrylate derivatives, PEG, and grafting polymers. The review concludes by exploring catalytic asymmetric transformations using chiral palladium complexes immobilized on polymer supports and discusses various chiral ligands and their immobilization on polymer supports, emphasizing their application in asymmetric allylic alkylation. The review furnishes a comprehensive summary of recent advancements, challenges, and prospective avenues in
::这篇综合综述探讨了催化转化方面的进展,重点是异质催化体系的使用,特别强调聚合物支撑的钯(Pd)络合物。本研究探讨了传统均相试剂的局限性,强调了向生态友好型催化体系的过渡,并强调了钯纳米颗粒的重要性。这些纳米颗粒因其独特的性质(包括较高的催化活性)而特别值得关注,使其在有机合成的各种应用中大有可为。该综述深入探讨了异相催化剂的设计与合成,强调了选择安全、可回收的载体以延长金属催化剂的寿命并提高其重复利用率的重要性。研究了各种聚合物,包括聚苯乙烯 (PS)、聚乙烯 (PE)、聚丙烯酸酯衍生物、聚乙二醇 (PEG) 和接枝聚合物,作为钯复合物的可行支撑物。作者详细描述了这些聚合物支撑钯催化剂的合成技术,并举例说明了它们在有机转化中的有效性。本综述还重点介绍了聚合物支撑的钯(Pd)材料的合成,并讨论了它们在电化学中的应用。重点延伸到钯基聚合物纳米材料的电催化特性,展示了它们在葡萄糖传感、过氧化氢检测和其他生物分析物传感中的有效性。此外,还探讨了钯纳米粒子在废水处理和电化学电容器等各种电化学应用中的催化能力。将聚合物支撑的钯材料整合到这些电化学过程中,凸显了它们的多功能性以及对催化和电化学传感领域进步的潜在贡献。在有机合成过程中,聚合物支持的钯配合物与聚合物配体的催化应用包括:Sonogashira 反应、Suzuki-Miyaura 偶联、Heck 反应、催化不对称转化等。论文接下来的部分重点介绍了通过聚合物配体与钯前体的络合反应生成聚合物钯络合物的过程。论文深入探讨了采用聚合物配体的聚合物支撑钯络合物的催化过程中值得注意的实例,重点介绍了不同的聚合物,如 PS、PE、聚丙烯酸酯衍生物、PEG 和接枝聚合物。综述最后探讨了固定在聚合物载体上的手性钯配合物的催化不对称转化,并讨论了各种手性配体及其在聚合物载体上的固定,强调了它们在不对称烯丙基烷基化中的应用。综述全面总结了聚合物载体钯催化剂在电化学应用催化氧化方面的最新进展、挑战和前景。
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引用次数: 0
Synthesis, Characterization, Antimicrobial Activity, and Molecular Docking Study of Newer Chalcone-based Triazolo Pyrimidine Compounds 新型查耳酮基三唑并嘧啶化合物的合成、表征、抗菌活性和分子对接研究
IF 2.6 3区 化学 Q3 Chemistry Pub Date : 2024-04-02 DOI: 10.2174/0113852728298472240305110906
Monik Gohil, Siva Prasad Das, Jeena Jyoti Boruah
:: In this work, we present the synthesis of a newer series of 15 chalcone-based pyrimidine compounds 4a-o. All the compounds were characterized by elemental analysis, melting point determination, mass, FTIR, and NMR analysis. We have evaluated the antimicrobial activity of these compounds. The compounds showed good inhibition activity towards different bacterial and fungal species such as S. aureus, S. pneumonia, E. coli, P. aeruginosa, Candida albicans, Aspergillus niger, and Alternaria alternata. Compounds 4c, 4h, 4k, and 4g showed comparable activities to those of commercially available drugs. Molecular docking study showed good interaction between each of the compounds and DNA gyrase enzyme. The docking score of the compounds ranges between -8.0 to -8.9 kcal/mol. Further, the ADMET analysis indicated the potential of the compounds as a drug candidate.
::在这项工作中,我们合成了一系列较新的 15 个基于查耳酮的嘧啶化合物 4a-o。我们通过元素分析、熔点测定、质量、傅立叶变换红外光谱和核磁共振分析对所有化合物进行了表征。我们评估了这些化合物的抗菌活性。这些化合物对金黄色葡萄球菌、肺炎双球菌、大肠杆菌、绿脓杆菌、白色念珠菌、黑曲霉和交替孢霉等不同细菌和真菌表现出良好的抑制活性。化合物 4c、4h、4k 和 4g 显示出与市售药物相当的活性。分子对接研究表明,每种化合物与 DNA 回旋酶之间都有良好的相互作用。化合物的对接得分在 -8.0 至 -8.9 kcal/mol 之间。此外,ADMET 分析表明这些化合物具有候选药物的潜力。
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引用次数: 0
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Current Organic Chemistry
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