dimethyl 5-[(6-benzyl-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-benzyl-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl)amino]benzene-1,3-dicarboxylate
dimethyl 5-[(6-benzyl-5-oxo-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-7-yl)amino]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C612-0385 |
| Compound Name: | dimethyl 5-[(6-benzyl-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: | COC(c1cc(cc(c1)NC1c2c(cccn2)C(N1Cc1ccccc1)=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9774 |
| logD: | 3.9774 |
| logSw: | -4.2339 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.259 |
| InChI Key: | KYOYDVGDJGSSGE-OAQYLSRUSA-N |