N-(2,5-dimethoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
N-(2,5-dimethoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1023 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-4-(thiophen-2-yl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | COc1ccc(c(c1)NC(N1Cc2ccccc2n2cccc2C1c1cccs1)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4641 |
| logD: | 5.4641 |
| logSw: | -5.4449 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.066 |
| InChI Key: | IRJKUJOVLIJIEI-DEOSSOPVSA-N |