Molecule ID: 4928

IUPAC Name: 6-methoxy-2-N,4-N-di(propan-2-yl)-1,3,5-triazine-2,4-diamine

Description: The molecule is a methoxy-1,3,5-triazine that is 6-methoxy-1,3,5-triazine-2,4-diamine in which the one of the hydrogens of each amino group is substituted by an isopropyl group. It has a role as a herbicide, an environmental contaminant and a xenobiotic. It is a diamino-1,3,5-triazine and a methoxy-1,3,5-triazine. It derives from a 6-methoxy-1,3,5-triazine-2,4-diamine.

SMILES: COc1nc(=NC(C)C)[nH]c(=NC(C)C)[nH]1

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

InChI: InChI=1S/C10H19N5O/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)

Molecular Properties:
- Polar Surface Area: 72.0 Ų
- LogP: 3.0