1,3,4-恶二唑衍生物的合成、脲酶抑制、抗氧化、抗菌及分子对接研究。

ISRN Pharmacology Pub Date : 2012-01-01 Epub Date: 2012-08-13 DOI:10.5402/2012/928901
Muhammad Hanif, Khurram Shoaib, Muhammad Saleem, Nasim Hasan Rama, Sumera Zaib, Jamshed Iqbal
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引用次数: 48

摘要

用二硫化碳在乙醇氢氧化钾中处理芳香酸肼,合成了18个1,3,4-恶二唑衍生物,得到了1,3,4-恶二唑的钾盐。用1n盐酸中和后得到1,3,4-恶二唑粗晶,用沸腾甲醇重结晶纯化。对合成的1,3,4-恶二唑类化合物的脲酶抑制活性进行了体外评价,结果表明,大多数化合物对豆角脲酶具有较强的抑制作用。通过分子对接研究,将其与豆角脲酶的晶体结构对接,观察合成化合物的相互作用模式。合成的化合物还进行了抗菌和抗氧化活性测试,一些衍生物显示出非常有希望的结果。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Synthesis, urease inhibition, antioxidant, antibacterial, and molecular docking studies of 1,3,4-oxadiazole derivatives.

Synthesis, urease inhibition, antioxidant, antibacterial, and molecular docking studies of 1,3,4-oxadiazole derivatives.

Synthesis, urease inhibition, antioxidant, antibacterial, and molecular docking studies of 1,3,4-oxadiazole derivatives.

Synthesis, urease inhibition, antioxidant, antibacterial, and molecular docking studies of 1,3,4-oxadiazole derivatives.

A series of eighteen 1,3,4-oxadiazole derivatives have been synthesized by treating aromatic acid hydrazides with carbon disulfide in ethanolic potassium hydroxide yielding potassium salts of 1,3,4-oxadiazoles. Upon neutralization with 1 N hydrochloric acid yielded crude crystals of 1,3,4-oxadiazoles, which were purified by recrystallization in boiling methanol. The synthesized 1,3,4-oxadiazoles derivatives were evaluated in vitro for their urease inhibitory activities, most of the investigated compounds were potent inhibitors of Jack bean urease. The molecular docking studies were performed by docking them into the crystal structure of Jack bean urease to observe the mode of interaction of synthesized compounds. The synthesized compounds were also tested for antibacterial and antioxidant activities and some derivatives exhibited very promising results.

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