rel-(3aR,6aR)-2-benzoyl-5-(4-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzoyl-5-(4-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzoyl-5-(4-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S984-0920 |
| Compound Name: | rel-(3aR,6aR)-2-benzoyl-5-(4-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 445.51 |
| Molecular Formula: | C22 H24 F N3 O4 S |
| Smiles: | CN(C)C([C@@]12CN(C[C@H]2CN(C1)S(c1ccc(cc1)F)(=O)=O)C(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3107 |
| logD: | 1.3107 |
| logSw: | -2.3459 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.792 |
| InChI Key: | NJYGLGHFQKDCSL-VGSWGCGISA-N |