Molecule ID: 70746

IUPAC Name: 2H-triazolo[4,5-d]pyrimidin-7-amine

Description: The molecule is a triazolopyrimidine that is [1,2,3]triazolo[4,5-d]pyrimidine bearing an amino substituent at position 7. It has a role as an EC 1.17.3.2 (xanthine oxidase) inhibitor and a Mycoplasma genitalium metabolite. It is a member of triazolopyrimidines, an aromatic amine and a nucleobase analogue.

SMILES: Nc1ncnc2[nH]nnc12

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

InChI: InChI=1S/C4H4N6/c5-3-2-4(7-1-6-3)9-10-8-2/h1H,(H3,5,6,7,8,9,10)

Molecular Properties:
- Polar Surface Area: 93.4 Ų
- LogP: -0.7