Molecule ID: 95827

IUPAC Name: 4-amino-5-chloro-1H-pyridazin-6-one

Description: The molecule is a heteroaryl hydroxy compound that is pyridazin-3-ol substituted by an amino group at position 5 and a chloro group at position 4. It is a metabolite of the herbicide chloridazone. It has a role as a marine xenobiotic metabolite. It is a member of pyridazines, an organochlorine compound, a heteroaryl hydroxy compound and a primary arylamine.

SMILES: Nc1cnnc(O)c1Cl

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

InChI: InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)

Molecular Properties:
- Polar Surface Area: 67.5 Ų
- LogP: -0.3