AC1MHL8S

2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl 2-[3-(trifluoromethylsulfanyl)anilino]benzoate;dihydrochloride

Also Known As: Benzoic acid, 2-((3-((trifluoromethyl)thio)phenyl)amino)-, 2-(4-(3-chlorophenyl)-1-piperazinyl)ethyl ester, dihydrochloride|2-[4-(3-chlorophenyl)piperazin-1-yl]ethyl 2-[3-(trifluoromethylsulfanyl)anilino]benzoate dihydrochloride|2-[4-(3-Chlorophenyl)piperazin-1-yl]ethyl 2-{3-[(trifluoromethyl)sulfanyl]anilino}benzoate--hydrogen chloride (1/2)

Molecular Formula	C26H27Cl3F3N3O2S
Molecular Weight	607.08417 g/mol
LogP	7.5181
Topological Polar Surface Area	44.81 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	8
Exact Mass	607.08417
Monoisotopic Mass	607.08417
Heavy Atoms	38
Complexity	1195.3951

Chemical Identifiers

CAS Number	69838-60-4
SMILES	C1CN(CCN1CCOC(=O)C2=CC=CC=C2NC3=CC(=CC=C3)SC(F)(F)F)C4=CC(=CC=C4)Cl.Cl.Cl