ethyl 4-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carbonyl)amino]benzoate
ethyl 4-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G211-0215 |
| Compound Name: | ethyl 4-[(2-cyclohexyl-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-b]quinoline-9-carbonyl)amino]benzoate |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(c1c2CN(C3CCCCC3)C(c2nc2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4188 |
| logD: | 5.4081 |
| logSw: | -5.6837 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.309 |
| InChI Key: | RSOFHZLXZFSQCE-UHFFFAOYSA-N |