rel-(3aR,6aR)-2-benzyl-N,N-dimethyl-5-(thiophene-2-sulfonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzyl-N,N-dimethyl-5-(thiophene-2-sulfonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzyl-N,N-dimethyl-5-(thiophene-2-sulfonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S985-1062 |
| Compound Name: | rel-(3aR,6aR)-2-benzyl-N,N-dimethyl-5-(thiophene-2-sulfonyl)hexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 419.56 |
| Molecular Formula: | C20 H25 N3 O3 S2 |
| Smiles: | CN(C)C([C@@]12CN(Cc3ccccc3)C[C@H]2CN(C1)S(c1cccs1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5463 |
| logD: | -1.2426 |
| logSw: | -2.2169 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.895 |
| InChI Key: | VBVUUMPXXLODQI-XLIONFOSSA-N |