首页> 外文期刊>Journal of enzyme inhibition and medicinal chemistry. >Synthesis, biological screening and molecular modeling studies of novel 3-chloro-4-substituted-1-(2-(1H-benzimidazol-2-yl)phenyl))-azetidin-2-ones
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Synthesis, biological screening and molecular modeling studies of novel 3-chloro-4-substituted-1-(2-(1H-benzimidazol-2-yl)phenyl))-azetidin-2-ones

机译:新型3-氯-4-取代-1-(2-(1H-苯并咪唑-2-基)苯基))-氮杂环丁烷-2-酮的合成,生物筛选和分子建模研究

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摘要

In the present investigation synthesis of some novel 1-(2-(1H-benzimidazol- 2-yl)phenyl)-3-chloro-4-(Un/substitutedphenyl)azetidin-2-one (3a-3h) antibacterial are reported. Structures of synthesized compounds were confirmed by spectral techniques (IR, Mass, 1H-NMR) All reactions were monitored with analytical thin layer chromatography. Synthesized compounds were docked in to the active site of enzyme transpeptidase. Compounds 3a, 3b, 3d and 3g were found to have good affinity for transpeptidase with potent antibacterial activity. A good correlation is found between in silico docking analysis and in vitro antibacterial activity.
机译:在本研究中,已报道了一些新型的1-(2-(1H-苯并咪唑-2-基)苯基)-3-氯-4-(Un /取代苯基)氮杂环丁烷-2-一(3a-3h)抗菌剂的合成。通过光谱技术(IR,Mass,1 H-NMR)确认合成的化合物的结构。所有反应均用分析型薄层色谱法监测。将合成的化合物对接至酶转肽酶的活性位点。发现化合物3a,3b,3d和3g对转肽酶具有良好的亲和力,具有有效的抗菌活性。在计算机对接分析和体外抗菌活性之间发现了良好的相关性。

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