AC1L4VYE

2-[4-[3-(3-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate

Also Known As: T-82|T 82|2-{4-[3-(3-chloro-10h-phenothiazin-10-yl)propyl]piperazin-1-yl}ethyl 3,4,5-trimethoxybenzoate|J3.022.176A|2-[4-[3-(3-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate|3-Chloro-6-(4'-hydroxyethylpiperazinyl)-1,1-propylphenothiazine 3'',4'',45''-trimethoxybenzoic acid|3,4,5-Trimethoxybenzoic acid, 2-(4-(3-(3-chloro-10H-phenothiazin-10-yl)propyl)-1-piperazinyl)ethyl ester|3,4,5-Trimethoxybenzoic acid 2-[4-[3-(3-chloro-10H-phenothiazine-10-yl)propyl]piperazino]ethyl ester

Molecular Formula	C31H36ClN3O5S
Molecular Weight	597.2064 g/mol
LogP	6.3
Topological Polar Surface Area	89.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	12
Exact Mass	597.2064
Monoisotopic Mass	597.2064
Heavy Atoms	41
Complexity	807.0

Chemical Identifiers

CAS Number	4875-39-2
SMILES	COC1=CC(=CC(=C1OC)OC)C(=O)OCCN2CCN(CC2)CCCN3C4=C(C=C(C=C4)Cl)SC5=CC=CC=C53
InChIKey	KZAJTVRKNKAXAG-UHFFFAOYSA-N