Molecule ID: 7547

IUPAC Name: 1-(4-chlorophenyl)-3-(3,4-dichlorophenyl)urea

Description: The molecule is a member of the class of phenylureas that is urea substituted by a 4-chlorophenyl group and a 3,4-dichlorophenyl group at positions 1 and 3 respectively. It has a role as a disinfectant, an antiseptic drug, an antimicrobial agent, an environmental contaminant and a xenobiotic. It is a dichlorobenzene, a member of monochlorobenzenes and a member of phenylureas. It derives from a 1,3-diphenylurea.

SMILES: OC(=Nc1ccc(Cl)c(Cl)c1)Nc1ccc(Cl)cc1

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

InChI: InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)

Molecular Properties:
- Polar Surface Area: 41.1 Ų
- LogP: 5.3