1-(3-chlorophenyl)-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-chlorophenyl)-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-chlorophenyl)-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J012-1818 |
| Compound Name: | 1-(3-chlorophenyl)-4-[3-methoxy-4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C23 H24 Cl N3 O3 |
| Smiles: | CC(C)COc1ccc(cc1OC)C1CC(Nc2c1cnn2c1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.137 |
| logD: | 5.1369 |
| logSw: | -5.7596 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.954 |
| InChI Key: | DTHYYSKMSAAGLR-SFHVURJKSA-N |