4-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Chemical Structure Depiction of
4-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
4-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide
Compound characteristics
| Compound ID: | G118-1548 |
| Compound Name: | 4-(3,4-dimethoxyphenyl)-N-(3-methylbutyl)-4H-pyrrolo[1,2-a][1,4]benzodiazepine-5(6H)-carboxamide |
| Molecular Weight: | 433.55 |
| Molecular Formula: | C26 H31 N3 O3 |
| Smiles: | CC(C)CCNC(N1Cc2ccccc2n2cccc2C1c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6951 |
| logD: | 5.6951 |
| logSw: | -5.4343 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.267 |
| InChI Key: | ZIYNLPWVCMCKHP-RUZDIDTESA-N |