Molecule ID: 5723

IUPAC Name: 3-[4-(difluoromethoxy)-3-methoxyphenyl]-1H-pyridazin-6-one

Description: The molecule is a pyridazinone derivative in which pyridazin-3(2H)-one is substituted at C-6 with a 4-(difluoromethoxy)-3-methoxyphenyl group. It is a phosphodiesterase inhibitor, selective for PDE3 and 4. It has a role as an EC 3.1.4.* (phosphoric diester hydrolase) inhibitor, a peripheral nervous system drug, an anti-asthmatic drug and a bronchodilator agent. It is an organofluorine compound and a pyridazinone.

SMILES: COc1cc(-c2ccc(O)nn2)ccc1OC(F)F

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

InChI: InChI=1S/C12H10F2N2O3/c1-18-10-6-7(2-4-9(10)19-12(13)14)8-3-5-11(17)16-15-8/h2-6,12H,1H3,(H,16,17)

Molecular Properties:
- Polar Surface Area: 59.9 Ų
- LogP: 2.2