methyl 4-[1-(4-methylphenyl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoate
Chemical Structure Depiction of
methyl 4-[1-(4-methylphenyl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoate
methyl 4-[1-(4-methylphenyl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoate
Compound characteristics
| Compound ID: | J012-3203 |
| Compound Name: | methyl 4-[1-(4-methylphenyl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoate |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C21 H19 N3 O3 |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)C(CC(N2)=O)c1ccc(cc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7841 |
| logD: | 3.7841 |
| logSw: | -3.9123 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.912 |
| InChI Key: | UGVOZMTZDWNCHF-KRWDZBQOSA-N |