Structural description, IR, TGA, antiradical, HRP activity inhibition and molecular docking exploration of N-cyclohexyl-N-tosylformamide

Journal of Molecular Structure(2022)

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摘要
•Synthesis and structural description and of N-cyclohexyl-N-tosylformamide 10 is presented.•NMR, IR, TGA and X-ray were used to characterized the structure of 10.•Hirshfeld surface, ESP, fingerprint and 3D-energy frameworks topology are described.•The antioxidant and anti-peroxidase activity of 10 was explored using DPPH, ABTS and HRP-H2O2/L012 techniques.•The docking results highlight interactions of 10 with HRP active site and confirmed the anti-peroxidase activity.
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关键词
N-sulfonylformamide,X-ray diffraction,Hirshfeld surface,Radical scavenging,Anti-peroxidase activity,Molecular docking
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