Synthesis, Biological Activity, and Molecular Docking Studied of New Substituted Hydrazones

Nabel B. Ayrim, Asim A. Balakit, S. J. Lafta
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Abstract

Series of new hydrazones derived from different carboxylic acid hydrazides and aromatic aldehydes (7-10, 20-25) have been synthesized and characterized by spectral techniques (FT-IR, 1H NMR, 13C NMR, and Mass spectrometry). The target compounds are designed to have the different substituents at the para position for both parts of the structures (hydrazide and aldehyde parts. The synthesized compounds have been evaluated as antimicrobial agents by studying their biological activity against two bacteria strains Staphylococcus aureus and Staphylococcus epidermidis (as gram-positive bacteria), Escherichia coli and Klebsiella sp (as gram-negative bacteria), the antifungal activity was studied against Candida albicans fungi. The obtained results showed a moderate antimicrobial activity for the test compounds when compared with ampicillin. The synthesized compounds were also subjected to molecular docking studies which were carried out against the bacteria strain Staphylococcus aureus DHFR. 
新型取代腙的合成、生物活性及分子对接研究
合成了一系列由不同羧酸酰肼和芳香醛(7- 10,20 -25)衍生的新型腙,并通过FT-IR、1H NMR、13C NMR和质谱等光谱技术对其进行了表征。目标化合物被设计为在结构的两个部分(肼和醛部分)的对位上具有不同的取代基。通过对金黄色葡萄球菌和表皮葡萄球菌(革兰氏阳性菌)、大肠杆菌和克雷伯氏菌(革兰氏阴性菌)的抑菌活性进行评价,并对白色念珠菌的抑菌活性进行了研究。所得结果表明,与氨苄西林相比,试验化合物具有中等的抗菌活性。合成的化合物还进行了针对金黄色葡萄球菌DHFR菌株的分子对接研究。
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