Molecule ID: 135410720

IUPAC Name: 2,6-dihydrotriazolo[4,5-d]pyrimidin-7-one

Description: The molecule is a triazolopyrimidine that consists of 1,4-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidine bearing an oxo substituent at position 7. It has a role as an antimalarial and an EC 2.4.2.8 (hypoxanthine phosphoribosyltransferase) inhibitor. It is a nucleobase analogue and a member of triazolopyrimidines.

SMILES: Oc1ncnc2[nH]nnc12

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

InChI: InChI=1S/C4H3N5O/c10-4-2-3(5-1-6-4)8-9-7-2/h1H,(H2,5,6,7,8,9,10)

Molecular Properties:
- Polar Surface Area: 83.0 Ų
- LogP: -1.0