Molecule ID: 135401907

IUPAC Name: 1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one

Description: The molecule is a bicyclic structure comprising a pyrazole ring fused to a hydroxy-substituted pyrimidine ring. It has a role as a radical scavenger, a gout suppressant, an antimetabolite and an EC 1.17.3.2 (xanthine oxidase) inhibitor. It is an organic heterobicyclic compound and a nucleobase analogue. It derives from a hydride of a 1H-pyrazolo[4,3-d]pyrimidine.

SMILES: Oc1ncnc2n[nH]cc12

SELFIES: [O][C][=N][C][=N][C][=N][NH1][C][=C][Ring1][=Branch2][Ring1][Branch1]

InChI: InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)

Molecular Properties:
- Polar Surface Area: 70.1 Ų
- LogP: -0.7