dimethyl 5-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C612-1000 |
| Compound Name: | dimethyl 5-{[6-(4-methylphenyl)-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C24 H21 N3 O5 |
| Smiles: | Cc1ccc(cc1)N1C(c2c(cccn2)C1=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3584 |
| logD: | 4.3584 |
| logSw: | -4.4671 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.647 |
| InChI Key: | PLMPRNKHFLTXSK-OAQYLSRUSA-N |