ethyl N-[4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl]glycinate
Chemical Structure Depiction of
ethyl N-[4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl]glycinate
ethyl N-[4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl]glycinate
Compound characteristics
| Compound ID: | G118-1062 |
| Compound Name: | ethyl N-[4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carbonyl]glycinate |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C21 H21 N3 O3 S |
| Smiles: | CCOC(CNC(N1Cc2ccccc2n2cccc2C1c1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9686 |
| logD: | 3.9686 |
| logSw: | -3.9029 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.342 |
| InChI Key: | XXSGCHNLFRPTAN-FQEVSTJZSA-N |