Molecule ID: 7541

IUPAC Name: 4,6-dichloro-N-(2-chlorophenyl)-1,3,5-triazin-2-amine

Description: The molecule is a member of the class of triazenes that is dichlorotriazene in which the hydrogen is replaced by an o-chloroanilino group. A fungicide formerly used to control leaf spots and downy mildew, it is no longer approved for use within the European Union. It has a role as an antifungal agrochemical. It is a member of triazines, an organochlorine pesticide, a secondary amino compound and a member of monochlorobenzenes.

SMILES: Clc1nc(Cl)[nH]c(=Nc2ccccc2Cl)n1

SELFIES: [Cl][C][N][=C][Branch1][C][Cl][NH1][C][=Branch1][O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][=Ring1][#C]

InChI: InChI=1S/C9H5Cl3N4/c10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h1-4H,(H,13,14,15,16)

Molecular Properties:
- Polar Surface Area: 50.7 Ų
- LogP: 3.0