Prashant P. Mogle, Sunil V. Gaikwad, Santosh S. Pohare, Madhav J. Hebade, Milind V. Gaikwad, Bhaskar S. Dawane
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引用次数: 0
摘要
在本研究工作中,我们努力采用一种绿色、高效、简单的方法,在环境可持续的 PEG-400 反应介质和可回收催化剂漂白土粘土(pH 值为 12.5,重量百分比为 10%)的存在下,一锅多组分合成新型 2-异烟酰胺基-4,6-二氢咪唑并[4,5-c] 吡唑-5 (2H)-one 衍生物。这种方法的优点是反应时间短、产品收率高、操作简便。采用琼脂井扩散法研究了合成衍生物对黑曲霉(MTCC280)、黄曲霉(MTCC3008)和柠檬青霉菌株的抗真菌效力。在测试的九种化合物中,有六种化合物显示出良好的抗真菌活性。利用 1H NMR、13C NMR、质谱和红外光谱方法对这些衍生物进行了表征。2-isonicotinoyl-4,6-dihydroimidazo[4,5-c] pyrazole-5 (2H)-one 衍生物与 PDB : 3KHM、14 α-demethylase (CYP51) from Trypanosoma cruzi in complex with inhibitor fluconazole protein 和 PDB : 6UW2 clotrimazole bound complex of Acanthamoeba castellanii CYP51 进行了分子对接研究。
Green Synthesis of 2-isonicotinoyl-4,6-dihydroimidazo[4,5-c] Pyrazol-5 (2H)-one Derivatives via One-pot Multicomponent Approach as a Potent Antifungal Agent
In the present research work, we made an effort to a green, efficient, and simple procedure for the one-pot multicomponent synthesis of novel 2-isonicotinoyl-4,6-dihydroimidazo[4,5-c] pyrazole-5 (2H)-one derivative in presence of environmentally sustainable PEG-400 reaction medium and recyclable catalyst bleaching earth clay (pH 12.5, 10% by weight). The benefits of this methodology include a quick reaction time, high product yield, and an easy work-up procedure. The antifungal potency was studied for synthesized derivatives using the agar well diffusion method against Aspergillus niger (MTCC280), Aspergillus flavus (MTCC3008), and Penicillium citrinum fungus strain. Among the tested compounds six from the nine compounds show promising antifungal activity among the tested compounds. The derivatives were characterized using 1H NMR, 13C NMR, Mass, and IR spectroscopic methods. Molecular docking study 2-isonicotinoyl-4,6-dihydroimidazo[4,5-c] pyrazole-5 (2H)-one derivative was conducted against the PDB : 3KHM, 14 α-demethylase (CYP51) from Trypanosoma cruzi in complex with inhibitor fluconazole protein and PDB : 6UW2 clotrimazole bound complex of Acanthamoeba castellanii CYP51.
期刊介绍:
The main scope of the journal is to publish original research articles in the wide field of chemical engineering including environmental and bioengineering.