RefChem:233691 structure

RefChem:233691

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

Also Known As: T-82|1-Piperazineethanol, 4-(1-(2-chloro-10-phenothiazinyl)-2-propyl)-, 3,4,5-trimethoxybenzoate|2-{4-[1-(2-chloro-10H-phenothiazin-10-yl)propan-2-yl]piperazin-1-yl}ethyl 3,4,5-trimethoxybenzoate|2-[4-[1-(2-chlorophenothiazin-10-yl)propan-2-yl]piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate|4-[1-[(2-Chloro-10H-phenothiazin-10-yl)methyl]ethyl]-1-piperazineethanol 3,4,5-trimethoxybenzoate

CAS: 3534-36-9
Molecular Formula C31H36ClN3O5S
Molecular Weight 597.2064 g/mol
LogP 6.1
Topological Polar Surface Area 89.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 9
Rotatable Bonds 11
Exact Mass 597.2064
Monoisotopic Mass 597.2064
Heavy Atoms 41
Complexity 822.0

Chemical Identifiers

CAS Number 3534-36-9
SMILES CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl)N4CCN(CC4)CCOC(=O)C5=CC(=C(C(=C5)OC)OC)OC
InChIKey NYDGBTCXTKAFNE-UHFFFAOYSA-N

Product Overview

RefChem:233691 (CAS 3534-36-9), with molecular formula C31H36ClN3O5S and molecular weight 597.2064 g/mol. IUPAC: 2-[4-[1-(2-chlorophenothiazin-10-yl)propan-2-yl]piperazin-1-yl]ethyl 3,4,5-trimethoxybenzoate.

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