AC1NPKLO

2-chloro-6-fluoro-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]benzamide

Also Known As: F0721-0399|2-chloro-6-fluoro-N-((4-(4-fluorophenyl)-5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)benzamide|2-chloro-6-fluoro-N-{[4-(4-fluorophenyl)-5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide|2-chloro-6-fluoro-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(4-fluorophenyl)-1,2,4-triazol-3-yl]methyl]benzamide

Molecular Formula	C24H17ClF3N5O2S
Molecular Weight	531.07434 g/mol
LogP	4.9988
Topological Polar Surface Area	88.91 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	531.07434
Monoisotopic Mass	531.07434
Heavy Atoms	36
Complexity	1377.8898

Chemical Identifiers

CAS Number	393872-11-2
SMILES	C1=CC(=C(C(=C1)Cl)C(=O)NCC2=NN=C(N2C3=CC=C(C=C3)F)SCC(=O)NC4=CC=C(C=C4)F)F