新型苯并噻唑类抗氧化抗炎药物POCl3介导的合成、药理评价及分子对接研究

Dattatraya G. Raut, S. Patil, P. Choudhari, Vikas D. Kadu, A. Lawand, M. Hublikar, R. Bhosale
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引用次数: 5

摘要

目前的研究重点是开发替代抗氧化和抗炎剂。文献综述表明,许多苯并噻唑类似物已被用作先导分子,用于抗癌、抗炎、抗氧化和抗病毒等治疗药物的设计和开发。对合成的苯并噻唑衍生物进行了体外抗氧化、抗炎活性评价和分子对接研究。因此,本研究旨在合成苯并噻唑衍生物,并测试其抗氧化和抗炎活性。设计并合成一种替代抗氧化和抗炎剂。用合适的羧酸与2-氨基噻吩在POCl3中进行环缩合反应,加热约2-3 h,得到取代的苯并噻唑3a-g。采用已知文献法对新合成的化合物进行体外抗炎和抗氧化活性筛选。首先,体外研究表明,与标准参比物相比,化合物代码3c, 3d和3具有明显的抗炎活性。所有测试的化合物都显示出对一种或多种活性自由基(H2O2,DPPH, SO和NO)清除物质的潜在抗氧化活性。此外,对化合物3d和3e进入抗炎活性位点的位置进行对接模拟,确定可能的结合模型。需要新的抗炎和抗氧化剂;实验证明,苯并噻唑类衍生物的3c、3d和3e构成了一种新的抗炎剂和抗氧化剂评价的有趣模板,也为进一步开发提供了一个有趣的模板。
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POCl3 Mediated Syntheses, Pharmacological Evaluation and Molecular Docking Studies of Some Novel Benzofused Thiazole Derivatives as a Potential Antioxidant and Anti-inflammatory Agents
The present research work is focused on the development of alternative antioxidant and anti-inflammatory agents. The review of the literature reveals that many benzofused thiazole analogues have been used as lead molecules for the design and development of therapeutic agent, including anticancer, anti-inflammatory, antioxidant and antiviral. The synthesized benzofused thiazole derivatives are evaluated for in vitro antioxidant, anti-inflammatory activities and molecular docking study. Thus, the present research work aims to synthesize benzofused thiazole derivatives and to test their antioxidant and antiinflammatory activities. To design and synthesize an alternative antioxidant and anti-inflammatory agents. The substituted benzofused thiazoles 3a-g were prepared by cyclocondensation reaction of appropriate carboxylic acid with 2-aminothiophenol in POCl3 and heated for about 2-3 h to offer benzofused thiazole derivatives 3a-g. All the newly synthesized compounds were in vitro screened for their anti-inflammatory and antioxidant activities by using a known literature method. At the outset, the study of in vitro indicated that the compounds code 3c, 3d and 3e possessed distinct anti-inflammatory activity as compared to a standard reference. All the tested compounds show potential antioxidant activity against one or more reactive (H2O2, DPPH, SO and NO) radical scavenging species. Additionally, docking simulation is further performed to the position of compounds 3d & 3e into the anti-inflammatory active site to determine the probable binding model. New anti-inflammatory and antioxidant agents were needed; it has been proved that benzofused thiazole derivatives were 3c, 3d and 3e constituted as an interesting template for the evaluation of new anti-inflammatory agents and an antioxidant’s work also may provide an interesting template for further development.
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来源期刊
Current Chemical Biology
Current Chemical Biology Medicine-Biochemistry (medical)
CiteScore
1.40
自引率
0.00%
发文量
16
期刊介绍: Current Chemical Biology aims to publish full-length and mini reviews on exciting new developments at the chemistry-biology interface, covering topics relating to Chemical Synthesis, Science at Chemistry-Biology Interface and Chemical Mechanisms of Biological Systems. Current Chemical Biology covers the following areas: Chemical Synthesis (Syntheses of biologically important macromolecules including proteins, polypeptides, oligonucleotides, oligosaccharides etc.; Asymmetric synthesis; Combinatorial synthesis; Diversity-oriented synthesis; Template-directed synthesis; Biomimetic synthesis; Solid phase biomolecular synthesis; Synthesis of small biomolecules: amino acids, peptides, lipids, carbohydrates and nucleosides; and Natural product synthesis).
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