AC1M3W7O structure

AC1M3W7O

2-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

Also Known As: 2-[5-({2-[(3-chloro-4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide|2-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide

CAS: 714282-07-2
Molecular Formula C20H16ClF4N5O2S
Molecular Weight 501.06494 g/mol
LogP 4.5384
Topological Polar Surface Area 88.91 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 501.06494
Monoisotopic Mass 501.06494
Heavy Atoms 33
Complexity 1185.5021

Chemical Identifiers

CAS Number 714282-07-2
SMILES CN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)F)Cl)CC(=O)NC3=CC=CC(=C3)C(F)(F)F

Product Overview

AC1M3W7O (CAS 714282-07-2), with molecular formula C20H16ClF4N5O2S and molecular weight 501.06494 g/mol. IUPAC: 2-[5-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-N-[3-(trifluoromethyl)phenyl]acetamide.

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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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