1-(1H-benzimidazol-2-yl)-4-{4-[(2-chlorophenyl)methoxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(1H-benzimidazol-2-yl)-4-{4-[(2-chlorophenyl)methoxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(1H-benzimidazol-2-yl)-4-{4-[(2-chlorophenyl)methoxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | 8019-6611 |
| Compound Name: | 1-(1H-benzimidazol-2-yl)-4-{4-[(2-chlorophenyl)methoxy]phenyl}-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 483.96 |
| Molecular Formula: | C27 H22 Cl N5 O2 |
| Smiles: | Cc1c2C(CC(Nc2n(c2nc3ccccc3[nH]2)n1)=O)c1ccc(cc1)OCc1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6995 |
| logD: | 2.5464 |
| logSw: | -4.8074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.537 |
| InChI Key: | RLEAYESIODVPNF-HXUWFJFHSA-N |