Molecule ID: 24798742

IUPAC Name: 5-chloro-4-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-7H-pyrrolo[2,3-d]pyrimidine

Description: The molecule is an imidazopyridine that is 4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine in which the amino hydrogen is replaced by a 5-chloro-1H-pyrrolo[2,3-d]pyrimidin-4-yl group. A potent inhibitor of AKT1 kinase. It has a role as an AKT1 kinase inhibitor. It is a pyrrolopyrimidine, an imidazopyridine, an organochlorine compound, a tertiary amino compound and an aromatic amine.

SMILES: Clc1c[nH]c2ncnc(N3CCc4nc[nH]c4C3)c12

SELFIES: [Cl][C][=C][NH1][C][=N][C][=N][C][Branch1][=C][N][C][C][C][N][=C][NH1][C][=Ring1][Branch1][C][Ring1][=Branch2][=C][Ring2][Ring1][C][Ring1][#C]

InChI: InChI=1S/C12H11ClN6/c13-7-3-14-11-10(7)12(18-6-17-11)19-2-1-8-9(4-19)16-5-15-8/h3,5-6H,1-2,4H2,(H,15,16)(H,14,17,18)

Molecular Properties:
- Polar Surface Area: 73.5 Ų
- LogP: 1.5