Molecule ID: 134160331

IUPAC Name: N-[2-[4-methoxy-3-(2-phenylethoxy)phenyl]ethyl]-N-propylpropan-1-amine;dihydrochloride

Description: The molecule is an aromatic ether that is (2-phenoxyethyl)benzene which carries a 2-(dipropylamino)ethyl group at position 3 and a methoxy group at position 6. It is a potent and selective sigma1 receptor antagonist. It has a role as an antipsychotic agent and a receptor modulator. It is an aromatic ether, a member of methoxybenzenes, a tertiary amino compound and a hydrochloride.

SMILES: CCCN(CCC)CCc1ccc(OC)c(OCCc2ccccc2)c1.Cl.Cl

SELFIES: [C][C][C][N][Branch1][Ring2][C][C][C][C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][N][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][P].[Cl].[Cl]

InChI: InChI=1S/C23H33NO2.2ClH/c1-4-15-24(16-5-2)17-13-21-11-12-22(25-3)23(19-21)26-18-14-20-9-7-6-8-10-20;;/h6-12,19H,4-5,13-18H2,1-3H3;2*1H

Molecular Properties:
- Polar Surface Area: 21.7 Ų
- LogP: nan