Molecular Docking and Antibacterial Studies of Pyranopyrazole Derivatives Synthesized Using [Pap-Glu@Chi] Biocatalyst Through a Greener Approach

Agrwal, Akansha; Pathak, Rajesh Kumar; Kasana, Virendra

doi:10.1007/s13369-021-05377-1

Cited by 17 publications

(15 citation statements)

References 59 publications

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“…Both ligand and target proteins were saved into .pdbqt format. The Grid box was set up with 70:64:56 A 0 along x, y, and z points, and coordinates 30.59, 15.855, and −3.947 were assigned to 2VF5 [24]. The Grid box for 2QZW was set up with 60:60:60 A 0 , and coordinates −16.302, −23.24, and −16.245 were assigned [25].…”

Section: Molecular Dockingmentioning

confidence: 99%

Microwave assisted synthesis of N‐substituted acridine‐1,8‐dione derivatives: Evaluation of antimicrobial activity

Kumar

Sarasija

Dharavath

et al. 2022

Journal of Heterocyclic Chem

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A simple and convenient one-pot method for the synthesis of N-substituted acridine derivatives from the condensation of 1,3-cyclohexanedione, substituted aryl amines, and 1,2,3-triazole aldehydes using a mixture of water/ ethanol as a reaction medium is reported. The current protocol delivers numerous advantages such as good yields, short reaction time, easy work-up, and simplicity in the procedure as it uses a green method and an eco-friendly catalyst. The target compounds are screened for their in vitro antimicrobial activity and most of the compounds are found to exhibit promising activity compared to standard drugs. The docking studies carried out using Autodock 4.2 were proven that all the molecules exhibited good interactions with protein glucosamine-6-phosphate synthase of Escherichia Coli and the secreted aspartic proteinase from Candida albicans and the docking results are in well agreement with antimicrobial activity.

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Section: Molecular Dockingmentioning

confidence: 99%

Microwave assisted synthesis of N‐substituted acridine‐1,8‐dione derivatives: Evaluation of antimicrobial activity

Kumar

Sarasija

Dharavath

et al. 2022

Journal of Heterocyclic Chem

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“…[3,4] . Among these, compound (1) is the most stable isomer. [5,6] It has other alternative names such as pyrano [2,3c]pyrazoles, 4H-pyrano [2,3-c]pyrazoles and also 1,4dihydropyrano [2,3-c]pyrazol-5-yl cyanides.…”

Section: Introductionmentioning

confidence: 99%

Recent Synthesis of Mono‐ & Bis‐Pyranopyrazole Derivatives

Farooq,

Ngaini

2024

ChemistrySelect

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Recent Synthesis of Mono‐ & Bis‐Pyranopyrazole Derivatives. Pyranopyrazole is an important structural unit in heterocyclic chemistry and is useful in pharmaceutical and agrochemical industries. The pyranopyrazole‐based compounds are known in the agricultural industry as herbicides, fungicides, and insecticide agents and in medicinal fields as antimicrobial, anticancer, and antiHIV agents. Despite its wide range of applications, the synthesis of pyranopyrazole has several limitations such as the cost of reagents, potential environmental risks, harsh reaction conditions, longer reaction times, laborious workup procedures, and unsatisfactory yields. However, many studies have been recently reported on the synthesis of pyranopyrazoles using mild, green, and environmentally friendly methods that also give higher yields. Different catalysts and conditions have been reported for the synthesis of pyranopyrazole using four, three, and two components. Among these, four‐component synthesis is commonly reported by using benzaldehyde, hydrazine derivatives, ethyl acetoacetate and malononitrile due to the commercial availability and stability of the reagents. This review summarized the recent synthesis of pyranopyrazole i. e., mono‐ and bis‐pyranopyrazole derivatives via four‐, three‐ and two‐component‐based reactions. Mono‐ and bis‐pyranopyrazole derivatives varied due to the number of pyranopyrazole units that contributed to play an important role in increasing the binding interaction and biological activities beneficial for pharmaceutical industries.

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“… 28 ) and biocatalyst, to improve its yields. 29 However, multicomponent reactions (MCRs) remained a useful strategy owing to great selectivity and high atomic economy. 30 In MCRs, all the reactants are added simultaneously in a one-pot manner that generally results in reducing the cost and time-effective synthesis of the desired products.…”

Section: Introductionmentioning

confidence: 99%

Synthesis, antioxidant activity, antimicrobial efficacy and molecular docking studies of 4-chloro-2-(1-(4-methoxyphenyl)-4,5-diphenyl-1H-imidazol-2-yl)phenol and its transition metal complexes

et al. 2023

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Molecular Docking and Antibacterial Studies of Pyranopyrazole Derivatives Synthesized Using [Pap-Glu@Chi] Biocatalyst Through a Greener Approach

Cited by 17 publications

References 59 publications

Microwave assisted synthesis of N‐substituted acridine‐1,8‐dione derivatives: Evaluation of antimicrobial activity

Microwave assisted synthesis of N‐substituted acridine‐1,8‐dione derivatives: Evaluation of antimicrobial activity

Recent Synthesis of Mono‐ & Bis‐Pyranopyrazole Derivatives

Synthesis, antioxidant activity, antimicrobial efficacy and molecular docking studies of 4-chloro-2-(1-(4-methoxyphenyl)-4,5-diphenyl-1H-imidazol-2-yl)phenol and its transition metal complexes

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