ethyl {4-[(4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]phenyl}acetate
Chemical Structure Depiction of
ethyl {4-[(4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]phenyl}acetate
ethyl {4-[(4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]phenyl}acetate
Compound characteristics
| Compound ID: | G118-0956 |
| Compound Name: | ethyl {4-[(4-phenyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl)amino]phenyl}acetate |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C29 H27 N3 O3 |
| Smiles: | CCOC(Cc1ccc(cc1)NC(N1Cc2ccccc2n2cccc2C1c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.82 |
| logD: | 5.82 |
| logSw: | -5.5022 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.73 |
| InChI Key: | UHHHRCZUBQJXHS-MUUNZHRXSA-N |