1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl)pyrrolidin-2-one
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl)pyrrolidin-2-one
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl)pyrrolidin-2-one
Compound characteristics
| Compound ID: | C743-0185 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(1,2,3,5-tetrahydro-4H-1,4-benzodiazepine-4-carbonyl)pyrrolidin-2-one |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C24 H29 N3 O4 |
| Smiles: | COc1ccc(CCN2CC(CC2=O)C(N2CCNc3ccccc3C2)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5387 |
| logD: | 1.5387 |
| logSw: | -2.2931 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.873 |
| InChI Key: | TWPBAKFOIPHZAS-LJQANCHMSA-N |