Molecule ID: 136165272

IUPAC Name: 2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidine-5-carboximidamide

Description: The molecule is a pyrrolopyrimidine that is 7-deazaguanine bearing a carboxamidine substituent at the 7 position. It is a pyrrolopyrimidine and a carboxamidine. It derives from a 7-carboxy-7-deazaguanine. It is a conjugate base of a 7-formamidino-7-deazaguanine(1+).

SMILES: N=C(N)c1c[nH]c2[nH]c(=N)nc(O)c12

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

InChI: InChI=1S/C7H8N6O/c8-4(9)2-1-11-5-3(2)6(14)13-7(10)12-5/h1H,(H3,8,9)(H4,10,11,12,13,14)

Molecular Properties:
- Polar Surface Area: 133.0 Ų
- LogP: -1.8