rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-{[2-(trifluoromethyl)phenyl]methyl}hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-{[2-(trifluoromethyl)phenyl]methyl}hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-{[2-(trifluoromethyl)phenyl]methyl}hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-1173 |
| Compound Name: | rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-{[2-(trifluoromethyl)phenyl]methyl}hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 445.48 |
| Molecular Formula: | C24 H26 F3 N3 O2 |
| Smiles: | CN(C)C([C@]12CN(Cc3ccccc3C(F)(F)F)C[C@@H]2CN(C1)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5284 |
| logD: | -0.8707 |
| logSw: | -2.817 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.814 |
| InChI Key: | SRKFCWUNAJRPNX-XXBNENTESA-N |