AC1NVFYE structure

AC1NVFYE

3-(5-chloro-2-hydroxyphenyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1H-pyrazole-5-carboxamide

Also Known As: AB00645723-06|5-(5-chloro-2-hydroxyphenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-pyrazole-3-carboxamide|(5Z)-5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2-dihydropyrazole-3-carboxamide|3-(5-chloro-2-hydroxyphenyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-pyrazole-5-carboxamide|5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2-dihydropyrazole-3-carboxamide|5-(5-Chloro-2-hydroxy-phenyl)-2H-pyrazole-3-carboxylic acid (1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-amide

CAS: 879462-63-2
Molecular Formula C21H18ClN5O3
Molecular Weight 423.1098 g/mol
LogP 3.48582
Topological Polar Surface Area 104.94 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 423.1098
Monoisotopic Mass 423.1098
Heavy Atoms 30
Complexity 1304.1758

Chemical Identifiers

CAS Number 879462-63-2
SMILES CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=NN3)C4=C(C=CC(=C4)Cl)O

Product Overview

AC1NVFYE (CAS 879462-63-2), with molecular formula C21H18ClN5O3 and molecular weight 423.1098 g/mol. IUPAC: 3-(5-chloro-2-hydroxyphenyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1H-pyrazole-5-carboxamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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