Molecule ID: 43226

IUPAC Name: (2-chlorophenyl)-(4-chlorophenyl)-pyrimidin-5-ylmethanol

Description: The molecule is a member of the class of pyrimidines that is pyrimidin-5-ylmethanol in which one of the hydrogens attached to the carbon bearing the hydroxy group is replaced by a 2-chlorophenyl group while the other is replaced by a 4-chlorophenyl group. It is a tertiary alcohol, a member of monochlorobenzenes and a member of pyrimidines.

SMILES: OC(c1ccc(Cl)cc1)(c1cncnc1)c1ccccc1Cl

SELFIES: [O][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]

InChI: InChI=1S/C17H12Cl2N2O/c18-14-7-5-12(6-8-14)17(22,13-9-20-11-21-10-13)15-3-1-2-4-16(15)19/h1-11,22H

Molecular Properties:
- Polar Surface Area: 46.0 Ų
- LogP: 3.6