rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(thiophene-3-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(thiophene-3-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(thiophene-3-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0951 |
| Compound Name: | rel-(3aR,6aR)-2-benzoyl-N,N-dimethyl-5-(thiophene-3-carbonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C21 H23 N3 O3 S |
| Smiles: | CN(C)C([C@@]12CN(C[C@H]2CN(C1)C(c1ccsc1)=O)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8545 |
| logD: | 0.8545 |
| logSw: | -1.8155 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.748 |
| InChI Key: | GJSZZMPPJJSCDM-LAUBAEHRSA-N |