ethyl N-{4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl}glycinate
Chemical Structure Depiction of
ethyl N-{4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl}glycinate
ethyl N-{4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl}glycinate
Compound characteristics
| Compound ID: | G118-0623 |
| Compound Name: | ethyl N-{4-[4-(propan-2-yl)phenyl]-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl}glycinate |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C26 H29 N3 O3 |
| Smiles: | CCOC(CNC(N1Cc2ccccc2n2cccc2C1c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6826 |
| logD: | 5.6826 |
| logSw: | -5.4639 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.323 |
| InChI Key: | MPWWOTNMDPHSRD-RUZDIDTESA-N |