October 2, 2024Journal of Heterocyclic Chemistry

N‐Methoxy Pyrazole‐4‐Carboxamide Derivatives: Synthesis, Spectral Analyses, Antifungal Activity, In Silico Molecular Docking, ADMET, and DFT Studies

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Authors

ZLZi‐Ting Luo BWBin Wang HWHong‐Ke Wu

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Overview

Experimental evaluation demonstrates potent antifungal activity of novel pyrazole-4-carboxamides against Sclerotinia sclerotiorum, suggesting their potential as agricultural fungicides.

Key Points

Novel pyrazole-4-carboxamide derivatives inhibit Sclerotinia sclerotiorum, with compound 3h achieving an EC50 of 7.80 μg/mL, comparable to bixafen at 6.70 μg/mL.
Assessment using X-ray diffraction, molecular docking simulation, ADMET analyses, and density functional theory characterized the synthesized pyrazole derivatives.
Highlights the utility of pyrazole-4-carboxamides as succinate dehydrogenase inhibitor fungicides, offering prospective chemical leads against fungal grain diseases.

Cite This Study

Luo et al. (2024) studied this question.

synapsesocial.com/papers/68e55ff7e2b3180350efc9bf https://doi.org/10.1002/jhet.4903

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October 2, 2024Journal of Heterocyclic Chemistry

N‐Methoxy Pyrazole‐4‐Carboxamide Derivatives: Synthesis, Spectral Analyses, Antifungal Activity, In Silico Molecular Docking, ADMET, and DFT Studies

View Full Paper

Ask AI

Bookmark

Authors

ZLZi‐Ting Luo BWBin Wang HWHong‐Ke Wu

Discussion

Member takes

Overview

Experimental evaluation demonstrates potent antifungal activity of novel pyrazole-4-carboxamides against Sclerotinia sclerotiorum, suggesting their potential as agricultural fungicides.

Key Points

Novel pyrazole-4-carboxamide derivatives inhibit Sclerotinia sclerotiorum, with compound 3h achieving an EC50 of 7.80 μg/mL, comparable to bixafen at 6.70 μg/mL.
Assessment using X-ray diffraction, molecular docking simulation, ADMET analyses, and density functional theory characterized the synthesized pyrazole derivatives.
Highlights the utility of pyrazole-4-carboxamides as succinate dehydrogenase inhibitor fungicides, offering prospective chemical leads against fungal grain diseases.

Cite This Study

Luo et al. (2024) studied this question.

synapsesocial.com/papers/68e55ff7e2b3180350efc9bf https://doi.org/10.1002/jhet.4903

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