4-[3-methoxy-4-(2-methylpropoxy)phenyl]-3-methyl-1-(6-methyl-1,3-benzothiazol-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-[3-methoxy-4-(2-methylpropoxy)phenyl]-3-methyl-1-(6-methyl-1,3-benzothiazol-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-[3-methoxy-4-(2-methylpropoxy)phenyl]-3-methyl-1-(6-methyl-1,3-benzothiazol-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-2216 |
| Compound Name: | 4-[3-methoxy-4-(2-methylpropoxy)phenyl]-3-methyl-1-(6-methyl-1,3-benzothiazol-2-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C26 H28 N4 O3 S |
| Smiles: | CC(C)COc1ccc(cc1OC)C1CC(Nc2c1c(C)nn2c1nc2ccc(C)cc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6418 |
| logD: | 5.6364 |
| logSw: | -5.4552 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.843 |
| InChI Key: | BKDWIHXZPKDYGA-SFHVURJKSA-N |