ethyl 3-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
ethyl 3-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate
Compound characteristics
| Compound ID: | C999-1165 |
| Compound Name: | ethyl 3-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzoate |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C23 H21 N3 O3 |
| Smiles: | CCOC(c1cccc(c1)NC1c2c(cccn2)C(N1c1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6657 |
| logD: | 4.6657 |
| logSw: | -4.4317 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.053 |
| InChI Key: | ZGBRODIBBUZSEO-OAQYLSRUSA-N |