ethyl 3-[(4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]benzoate
Chemical Structure Depiction of
ethyl 3-[(4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]benzoate
ethyl 3-[(4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | G118-0765 |
| Compound Name: | ethyl 3-[(4-ethyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]benzoate |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C24 H25 N3 O3 |
| Smiles: | CCC1c2cccn2c2ccccc2CN1C(Nc1cccc(c1)C(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6936 |
| logD: | 5.6936 |
| logSw: | -5.4211 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.549 |
| InChI Key: | QCGKZMIZKGEDJG-FQEVSTJZSA-N |