1-(1H-benzimidazol-2-yl)-3-methyl-4-(2-methyl-1-benzothiophen-3-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(1H-benzimidazol-2-yl)-3-methyl-4-(2-methyl-1-benzothiophen-3-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(1H-benzimidazol-2-yl)-3-methyl-4-(2-methyl-1-benzothiophen-3-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J094-0640 |
| Compound Name: | 1-(1H-benzimidazol-2-yl)-3-methyl-4-(2-methyl-1-benzothiophen-3-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 413.5 |
| Molecular Formula: | C23 H19 N5 O S |
| Smiles: | Cc1c2C(CC(Nc2n(c2nc3ccccc3[nH]2)n1)=O)c1c2ccccc2sc1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2166 |
| logD: | 2.0635 |
| logSw: | -4.2537 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.056 |
| InChI Key: | MUUMFBSWHPNAFW-HNNXBMFYSA-N |