AC1NG3ZK structure

AC1NG3ZK

4-benzoyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Also Known As: F0417-0814|4-benzoyl-N-{5-[({[2-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide|4-benzoyl-N-(5-((2-oxo-2-((2-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|4-benzoyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

CAS: 392297-29-9
Molecular Formula C25H17F3N4O3S2
Molecular Weight 542.0694 g/mol
LogP 5.771
Topological Polar Surface Area 101.05 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 542.0694
Monoisotopic Mass 542.0694
Heavy Atoms 37
Complexity 1425.1349

Chemical Identifiers

CAS Number 392297-29-9
SMILES C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC(=O)NC4=CC=CC=C4C(F)(F)F

Product Overview

AC1NG3ZK (CAS 392297-29-9), with molecular formula C25H17F3N4O3S2 and molecular weight 542.0694 g/mol. IUPAC: 4-benzoyl-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.

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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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