Molecule ID: 3317081

IUPAC Name: 1-[[3-(2-chlorophenyl)-2-(4-fluorophenyl)oxiran-2-yl]methyl]-1,2,4-triazole

Description: The molecule is an epoxide that is oxirane substituted by a 2-chlorophenyl, 4-fluorophenyl and a 1H-1,2,4-triazol-1-ylmethyl groups. It is an epoxide, a member of monochlorobenzenes, a member of monofluorobenzenes and a member of triazoles.

SMILES: Fc1ccc(C2(Cn3cncn3)OC2c2ccccc2Cl)cc1

SELFIES: [F][C][=C][C][=C][Branch2][Ring1][=Branch2][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][O][C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][Ring2][Ring1][=Branch1]

InChI: InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2

Molecular Properties:
- Polar Surface Area: 43.2 Ų
- LogP: 3.2