新的 1,2,3-三唑系链查耳酮衍生物:合成、生物评估和计算研究

IF 2.4 3区 化学 Q2 CHEMISTRY, ORGANIC
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引用次数: 0

摘要

为了寻找新的活性分子,我们通过点击化学方法高效地制备了一个小型的基于 1,2,3-三唑的查尔酮衍生物库。利用红外光谱、1H NMR、13C NMR 和质谱技术对所有合成化合物进行了表征。合成的基于 1,2,3 三唑的新型查尔酮衍生物的抗炎和抗氧化活性得到了评估。此外,分子建模研究表明,这些衍生物与环氧合酶 2(COX-2)活性位点有很好的结合亲和力,从而证明了该支架具有进一步优化的潜力。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
New 1,2,3‐Triazole‐Tethered Chalcone Derivatives: Synthesis, Bioevaluation and Computational Study
In search of new active molecules, a small focused library of novel 1,2,3-triazoles based chalcone derivatives has been efficiently prepared via the click chemistry approach. All the synthesized compounds were characterized with the help of IR, 1H NMR, 13C NMR and mass spectroscopic techniques. The synthesized novel 1,2,3-triazoles based chalcone derivatives evaluated for their anti-inflammatory and antioxidant activity. Furthermore, molecular modeling study could support these outcomes by demonstrating very good binding affinities at the active site of the cyclooxygenase 2 (COX-2) iterating the potential of this scaffold for further optimization.
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来源期刊
Polycyclic Aromatic Compounds
Polycyclic Aromatic Compounds 化学-有机化学
CiteScore
3.70
自引率
20.80%
发文量
412
审稿时长
3 months
期刊介绍: The purpose of Polycyclic Aromatic Compounds is to provide an international and interdisciplinary forum for all aspects of research related to polycyclic aromatic compounds (PAC). Topics range from fundamental research in chemistry (including synthetic and theoretical chemistry) and physics (including astrophysics), as well as thermodynamics, spectroscopy, analytical methods, and biology to applied studies in environmental science, biochemistry, toxicology, and industry. Polycyclic Aromatic Compounds has an outstanding Editorial Board and offers a rapid and efficient peer review process, as well as a flexible open access policy.
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