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Comment on the paper "Efficient effects of chemical reactions and thermal radiationon unsteady magnetohydrodynamic mixed convection in hybrid nanofluid flow over a nonlinearly stretched sheet, S.K.Prasanna Lakshmi, S. Sreedhar, Charankumar Ganteda, S. Maddila, Chemical Data Collections 50(2024) 101124" 对论文 "Efficient effects of chemical reactions and thermal radiationon unsteady magnetohydrodynamic mixed convection in hybrid nanofluid flow over a nonlinearly stretched sheet, S.K.Prasanna Lakshmi, S. Sreedhar, Charankumar Ganteda, S. Maddila, Chemical Data Collections 50(2024) 101124 "的评论
IF 2.218 Q2 Chemistry Pub Date : 2024-06-25 DOI: 10.1016/j.cdc.2024.101154
Asterios Pantokratoras

A serious error exists in the above paper.

上述论文中存在一个严重错误。
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引用次数: 0
Boosting the corrosion inhibition efficiency of the Clerodendrum serratum extract for steel in the presence of KCl 在氯化钾条件下提高红花檵木提取物对钢铁的缓蚀效率
IF 2.218 Q2 Chemistry Pub Date : 2024-06-14 DOI: 10.1016/j.cdc.2024.101148
Anusuya Dutta, Jasdeep Kaur, Akhil Saxena

The impact of an extract from the Clerodendrum serratum plant on steel corrosion in a sulfuric acid solution was examined using weight loss analysis and electrochemical impedance spectroscopy (EIS). This research delves into the synergistic corrosion inhibition efficiency of Clerodendrum serratum in the presence of KCl. This extract contains Apigenin, Hispidulin, 7- hydroxyflavanone, Oleanolic acid, β-sitosterol, Campesterol, Stigmasterol, Ursolic acid, Serratin, Spinasterol, Queretaroic acid etc. The anti-corrosive properties of this extract are primarily attributed to the presence of numerous bonds and heteroatoms in its phytochemical composition. Instrumentation such as UV analysis provides detailed insights into molecular interactions, aiding in the understanding of inhibitive mechanisms. The effectiveness of corrosion inhibition improves as the concentration of plant extract is raised up to 3000 ppm. Utilizing Potentiodynamic polarization (PDP) examination, achieving 88.6 % efficiency without KCl and 93.05 % in the presence of KCl demonstrates a comprehensive approach for improving protective characteristics in practical applications.

研究人员利用失重分析和电化学阻抗光谱(EIS)技术,考察了蛇床子提取物对硫酸溶液中钢铁腐蚀的影响。这项研究深入探讨了蛇床子在氯化钾存在下的协同缓蚀效率。该提取物含有芹菜素、糙皮素、7-羟基黄烷酮、齐墩果酸、β-谷甾醇、坎佩甾醇、豆甾醇、熊果酸、山梨醇、刺五加醇、藜芦酸等。这种提取物的防腐特性主要归因于其植物化学成分中存在大量的键和杂原子。紫外线分析等仪器可以详细了解分子间的相互作用,有助于对抑制机理的理解。当植物提取物的浓度提高到 3000 ppm 时,缓蚀效果就会提高。利用电位动力极化(PDP)检查,在不含氯化钾的情况下,效率达到 88.6%,而在含有氯化钾的情况下,效率达到 93.05%,这表明在实际应用中,有一种全面的方法可以提高保护特性。
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引用次数: 0
Synthesis and biological evaluation of substituted benzohydrazide Schiff base adduct as potential cholinesterase inhibitors 作为潜在胆碱酯酶抑制剂的取代苯甲酰肼席夫碱加合物的合成与生物学评价
IF 2.218 Q2 Chemistry Pub Date : 2024-06-10 DOI: 10.1016/j.cdc.2024.101151
Ahmad Zulfiqar , Irshad Ullah Khan , Muhammad Nabi , Hayat Ullah , Naveed Iqbal , Benish Zeb , Amjad Hussain , Daud Khan , Abdur Rab , Sayyed Muhammad Junaid , Muhammad Taha , Syed Adnan Ali Shah , Fazal Rahim

A total of Twenty two (22) derivatives of benzohydrazide bearing Schiff base have been synthesized, characterized through 1HNMR, 13C NMR and screened against cholinesterase inhibitory potentials. All the adducts (1–22) showed varying degree of cholinesterase inhibitory potential IC50 ranging between 13.23 ± 0.02 to 59.09 ± 1.22 µM against acetylcholinesterase, with IC50 values ranging from 23.55 ± 0.32 to 61.55 ± 0.58 µM against butyrylcholinesterase. Among the series analogs 1, 3, 8, 12, 14, 15, 17, 18 and 22 with IC50 values 20.05 ± 0.13, 17.32 ± 0.15, 14.32 ± 0.97, 23.33 ± 0.56, 18.02 ± 0.09, 19.05 ± 0.13, 15.11 ± 0.23, 13.23 ± 0.02, and 22.57 ± 0.09 µM respectively showed excellent inhibitory potential against acetylcholinesterase and with IC50 values 31.46 ± 0.98, 26.06 ± 0.08, 25.33 ± 1.49, 30.12 ± 0.78, 28.11 ± 0.5, 29.33 ± 0.19, 25.37 ± 0.47, 23.55 ± 0.32 and 33.12 ± 0.78 against butylcholinesterase as compared to the standard Galanthamine. All other analogs showed moderate inhibitory potential. A structure-activity relationship has been established for all compounds. Through molecular docking studies, the interactions between compounds with the enzyme active sites were confirmed.

通过 1HNMR、13C NMR 和胆碱酯酶抑制潜能筛选,共合成了 22 种含希夫碱的苯甲酰肼衍生物。所有加合物(1-22)都显示出不同程度的胆碱酯酶抑制潜能,对乙酰胆碱酯酶的 IC50 值在 13.23 ± 0.02 至 59.09 ± 1.22 µM 之间,对丁酰胆碱酯酶的 IC50 值在 23.55 ± 0.32 至 61.55 ± 0.58 µM 之间。系列类似物 1、3、8、12、14、15、17、18 和 22 的 IC50 值分别为 20.05 ± 0.13、17.32 ± 0.15、14.32 ± 0.97、23.33 ± 0.56、18.02 ± 0.09、19.05 ± 0.13、15.11 ± 0.23、13.23 ± 0.02 和 22.57 ± 0.09 µM。与标准品加兰他敏相比,其他类似物对乙酰胆碱酯酶的 IC50 值分别为 31.46 ± 0.98、26.06 ± 0.08、25.33 ± 1.49、30.12 ± 0.78、28.11 ± 0.5、29.33 ± 0.19、25.37 ± 0.47、23.55 ± 0.32 和 33.12 ± 0.78。所有其他类似物都显示出中等抑制潜力。所有化合物都建立了结构-活性关系。通过分子对接研究,确认了化合物与酶活性位点之间的相互作用。
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引用次数: 0
Application of expired Febuxostat drug as an effective corrosion inhibitor for steel in acidic medium: Experimental and theoretical studies 过期非布索坦药物作为钢在酸性介质中的有效缓蚀剂的应用:实验和理论研究
IF 2.218 Q2 Chemistry Pub Date : 2024-06-07 DOI: 10.1016/j.cdc.2024.101149
Mohit Jaiswal, Akhil Saxena, Jasdeep Kaur

This work investigates the possibility of using expired Febuxostat, a drug mainly used to treat gout, as a corrosion inhibitor for steel in solutions containing Hydrochloric acid (HCl), which is an unusual but potentially successful approach. The goal of this research is to recycle pharmaceutical waste for useful purposes while also meeting the requirement for sustainable and economical corrosion mitigation techniques. The study includes various analytical techniques, like SEM, weight loss, electrochemical techniques, and density functional theory (DFT) to evaluate the efficacy of expired febuxostat as a corrosion inhibitor for steel in 0.5 M HCl solution. The EIS and PDP curve results showed a direct correlation between the concentration of Febuxostat and the inhibition efficiency. The active center of the electrode surface is blocked by the drug molecules, which reduces the corrosion mechanism. The data from the Langmuir adsorption isotherm validates a physiochemical process. Moreover, SEM investigations show that steel has a smoother surface. The adsorption behavior of Febuxostat molecules on the steel surface is investigated, providing insight into the chemical mechanisms underlying the inhibitory effect.

这项研究探讨了在含有盐酸(HCl)的溶液中使用过期非布索坦(一种主要用于治疗痛风的药物)作为钢材缓蚀剂的可能性,这是一种不同寻常但可能成功的方法。这项研究的目标是回收制药废料用于有用的目的,同时满足对可持续和经济的缓蚀技术的要求。研究采用了各种分析技术,如扫描电镜、失重、电化学技术和密度泛函理论(DFT),以评估过期非布索坦作为 0.5 M HCl 溶液中钢的缓蚀剂的功效。EIS 和 PDP 曲线结果表明,非布索坦的浓度与缓蚀效率直接相关。电极表面的活性中心被药物分子阻挡,从而降低了腐蚀机理。朗缪尔吸附等温线的数据验证了一种生化过程。此外,扫描电镜研究表明,钢的表面更加光滑。通过研究非布索坦分子在钢表面的吸附行为,可以深入了解抑制作用的化学机制。
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引用次数: 0
Green synthesis and characterization of silver (Ag) nanoparticles from aqueous bulb extract of Urginea indica (Roxb.) Kunth and its antimicrobial activity 从 Urginea indica(Roxb.
IF 2.218 Q2 Chemistry Pub Date : 2024-06-06 DOI: 10.1016/j.cdc.2024.101150
Uday Sahu, Shriram Kunjam

The present study explores the green synthesis of silver nanoparticles (AgNPs) using Urginea indica (Roxb.) Kunth bulb extract, emphasizes its eco-friendly and cost-effective nature. Characterization techniques, including UV-Vis Spectrophotometer, FTIR spectroscopy, XRD, and TEM, confirmed the successful synthesis, revealing spherical AgNPs with a size range of 9-30 nm. In antimicrobial activity, these nanoparticles exhibited significant growth inhibition activity against bacteria like Pseudomonas aeruginosa (22.66 ± 3.05 mm), S. aureus (15.33 ± 0.57 mm), E. coli (14 ± 1 mm), and fungi like Candida albicans (35.6 mm), with a notable zone of inhibition. The phytochemical analysis of the bulb extract reveals that it has various bioactive compounds, such as phenols, flavonoids, saponins, glycosides, terpenoids, and steroids, likely contributing to the reduction and stabilization of AgNPs. The green synthesis process was used for its simplicity, cleanliness, and lack of pollutants. The study shows how natural resources can be used to develop nanoparticles to fight against increasing drug resistance problems.

本研究探讨了利用鳞茎提取物(Urginea indica (Roxb.) Kunth bulb extract)合成银纳米粒子(AgNPs)的绿色方法,强调了其环保性和成本效益。紫外-可见分光光度计、傅立叶变换红外光谱、X射线衍射和透射电镜等表征技术证实了该方法的成功合成,发现了尺寸范围为9-30 nm的球形银纳米粒子。在抗菌活性方面,这些纳米颗粒对铜绿假单胞菌(22.66 ± 3.05 mm)、金黄色葡萄球菌(15.33 ± 0.57 mm)、大肠杆菌(14 ± 1 mm)等细菌和白色念珠菌(35.6 mm)等真菌具有显著的生长抑制活性,抑制区明显。鳞茎提取物的植物化学分析显示,它含有多种生物活性化合物,如酚类、黄酮类、皂苷类、苷类、萜类和类固醇,可能有助于还原和稳定 AgNPs。绿色合成工艺因其简单、清洁和无污染物而被采用。这项研究显示了如何利用自然资源来开发纳米粒子,以应对日益严重的抗药性问题。
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引用次数: 0
Rational design, synthesis, and anticancer evaluation of amide derivatives of Pyridin3-yl)imidazo[2,1-b][1,3,4]thiadiazole linked 1,3,4-oxadiazoles 吡啶-3-基)咪唑并[2,1-b][1,3,4]噻二唑与 1,3,4-恶二唑连接的酰胺衍生物的合理设计、合成和抗癌评估
IF 2.218 Q2 Chemistry Pub Date : 2024-06-02 DOI: 10.1016/j.cdc.2024.101147
Khasim Saheb Shaik , Saritha N , Nagendra Reddy G

A new series of amides of pyridin-3-yl)imidazo[2,1-b][1,3,4]thiadiazoles (13a-j) have been developed and confirmed by 1HNMR, 13CNMR and mass spectral data. Further, in the vitro anticancer activity of newly prepared compounds 13a-j was examined against four human cancer cell lines including MCF-7 & MDA MB-231 (human breast cancer), A549 (human lung cancer) and DU-145 (human prostate cancer) by employing the MTT assay, and using etoposide as a standard reference. These results indicated that the most of the derivatives displayed excellent to moderate anticancer activity. Among the five compounds 13a, 13b, 13c, 13d and 13e demonstrated remarkable activity as standard. One of the compounds 13a displayed excellent activity.

研究人员开发了一系列新的吡啶-3-基)咪唑并[2,1-b][1,3,4]噻二唑酰胺类化合物(13a-j),并通过 1HNMR、13CNMR 和质谱数据进行了证实。此外,以依托泊苷为标准参照物,采用 MTT 法检测了新制备的 13a-j 化合物对四种人类癌细胞系(包括 MCF-7 &、MDA MB-231(人类乳腺癌)、A549(人类肺癌)和 DU-145(人类前列腺癌))的体外抗癌活性。这些结果表明,大多数衍生物都显示出了极佳至中等程度的抗癌活性。在五种化合物中,13a、13b、13c、13d 和 13e 具有显著的标准活性。其中一个化合物 13a 表现出了极佳的活性。
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引用次数: 0
Design, synthesis and biological evaluation of sulfonamide derivatives of Benzothiazol-Quinoline-Pyrazoles as anticancer agents 作为抗癌剂的苯并噻唑-喹啉-吡唑磺酰胺衍生物的设计、合成和生物学评价
IF 2.218 Q2 Chemistry Pub Date : 2024-06-01 DOI: 10.1016/j.cdc.2024.101136
Perugu Edukondalu , Reddymasu Sireesha , Pushpalatha Kavuluri , Paila Suresh , Gadupudi Purna Chandra Rao , Choragudi Chandrasekhar , Rudraraju Ramesh Raju

A new library of sulfonamide derivatives of benzothiazol-quinoline-pyrazole (11a-j) were design and synthesized and their chemical structures were confirmed by 1HNMR, 13CNMR and mass spectral data. Further, all derivatives were evaluated for their preliminary anticancer applications against a panel of four human cancer cell lines such as prostate cancer cell (PC3), lung cancer cell (A549), breast cancer cell (MCF-7) and prostate cancer cell (DU-145) by using of MTT method and the obtained results were expressed with IC50 µM. Most of the screened compounds were displayed moderate to good activity and etoposide utilized as positive control. Among them, five compounds 11a, 11b, 11 h, 11i and 11j were revealed more potent activities.

设计并合成了一个新的苯并噻唑-喹啉-吡唑磺酰胺衍生物库(11a-j),并通过 1HNMR、13CNMR 和质谱数据确认了它们的化学结构。此外,利用 MTT 法评估了所有衍生物对四种人类癌细胞系(如前列腺癌细胞(PC3)、肺癌细胞(A549)、乳腺癌细胞(MCF-7)和前列腺癌细胞(DU-145))的初步抗癌应用,所得结果以 IC50 µM 表示。以依托泊苷为阳性对照,大多数筛选出的化合物都显示出中等至良好的活性。其中,11a、11b、11 h、11i 和 11j 五种化合物具有更强的活性。
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引用次数: 0
Effects of convective heating and suction/injection on mixed convective flow of a nanofluid over rotating truncated cone 对流加热和吸入/注入对旋转截顶锥上纳米流体混合对流的影响
IF 2.218 Q2 Chemistry Pub Date : 2024-06-01 DOI: 10.1016/j.cdc.2024.101144
Chandaka Uma Sankar , Sreedhar Sobhanapuram , S.V.V Rama Devi , Suresh Maddila

This paper investigates the mixed convective pour of a nanofluid through warmth as well as accumulation transport induced by the vertical rotation of a permeable truncated cone. The study considers convective-type thermal boundary conditions and zero nanoparticle mass flux conditions. The effects of thermophoresis and Brownian motion have been integrated into the present nanofluid model. To transform the coupled non-linear border line sheet equations into dimensionless partial differential equations, a set of non-similarity transformations is introduced. The ensuing PDEs are then numerically figured out using a Spectral collocation method in conjunction with the local linearization technique. To authenticate the numerical technique, the obtained outcomes are in contrast to with established findings in a specific case. The manipulate of a variety of corporeal constraints inactive on the tangential and swirl velocities of the nanofluid, as well as warmth, hard volume fraction, as well as exterior drag, warmth, as well as accumulation transport characteristics, are discussed.

本文研究了纳米流体在透气截顶锥垂直旋转的诱导下,通过热量和积聚传输进行的混合对流倾注。研究考虑了对流型热边界条件和零纳米粒子质量通量条件。热泳和布朗运动的影响已被纳入本纳米流体模型。为了将耦合的非线性边界线片方程转化为无量纲偏微分方程,引入了一组非相似性变换。随后,利用光谱配位法和局部线性化技术对随后的偏微分方程进行数值计算。为了验证数值技术,将获得的结果与特定情况下的既定结论进行对比。此外,还讨论了纳米流体的切向速度和漩涡速度、温度、硬体积分数以及外部阻力、温度和积聚传输特性等各种体质约束条件对纳米流体的影响。
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引用次数: 0
Comments on “volumetric properties of binary mixtures of (ethylene glycol or glycerol + benzene or cyclohexane or hexane) at varying temperatures” 关于 "不同温度下(乙二醇或甘油 + 苯或环己烷或正己烷)二元混合物的体积特性 "的评论
IF 2.218 Q2 Chemistry Pub Date : 2024-06-01 DOI: 10.1016/j.cdc.2024.101130
William E. Acree

A polemic is given regarding the volumetric properties reported by Ramadevi and coworkers for binary systems containing either ethylene glycol or glycerol mixed with either hexane or cyclohexane or benzene. The six binary systems studied by the authors are not completely miscible, and separate into a polyhydroxy alcohol-rich liquid phase and an alkane-rich liquid phase.

Ramadevi 和同事报告了含有乙二醇或甘油与正己烷或环己烷或苯混合的二元体系的体积特性,对此进行了论证。作者研究的六种二元体系并非完全混溶,而是分离成富含多羟基醇的液相和富含烷烃的液相。
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引用次数: 0
Rational design, synthesis and biological evaluation of Isoxazole incorporated Oxazol-4-yl-1-(pyridin-4-yl)-1H-pyrazole as anticancer agents 作为抗癌剂的异噁唑并噁唑-4-基-1-(吡啶-4-基)-1H-吡唑的合理设计、合成和生物学评价
IF 2.218 Q2 Chemistry Pub Date : 2024-06-01 DOI: 10.1016/j.cdc.2024.101146
T. Yakantham, S. Gouthamsri, Gadupudi Purna Chandra Rao, Paila Suresh, Eeduri Ramya Devi, R. R. Raju
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引用次数: 0
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