rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(3-methylbutanoyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(3-methylbutanoyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(3-methylbutanoyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0926 |
| Compound Name: | rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(3-methylbutanoyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 371.48 |
| Molecular Formula: | C21 H29 N3 O3 |
| Smiles: | CC(C)CC(N1C[C@@H]2CN(C[C@@]2(C1)C(N(C)C)=O)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0325 |
| logD: | 1.0325 |
| logSw: | -1.7904 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.474 |
| InChI Key: | OOQMMAWGUKIWBO-UTKZUKDTSA-N |