rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethylbenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethylbenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethylbenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0128 |
| Compound Name: | rel-(3aR,6aR)-2-benzyl-5-(2,4-dimethylbenzoyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C25 H31 N3 O2 |
| Smiles: | Cc1ccc(C(N2C[C@@H]3CN(Cc4ccccc4)C[C@@]3(C2)C(N(C)C)=O)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7229 |
| logD: | -1.6764 |
| logSw: | -3.0275 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.814 |
| InChI Key: | CISFTDIGFXNSBT-BWKNWUBXSA-N |