rel-(3aR,6aR)-2-benzyl-5-(3-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Chemical Structure Depiction of
rel-(3aR,6aR)-2-benzyl-5-(3-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
rel-(3aR,6aR)-2-benzyl-5-(3-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide
Compound characteristics
| Compound ID: | S985-1064 |
| Compound Name: | rel-(3aR,6aR)-2-benzyl-5-(3-fluorobenzene-1-sulfonyl)-N,N-dimethylhexahydropyrrolo[3,4-c]pyrrole-3a(1H)-carboxamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C22 H26 F N3 O3 S |
| Smiles: | CN(C)C([C@@]12CN(Cc3ccccc3)C[C@H]2CN(C1)S(c1cccc(c1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0293 |
| logD: | -0.7596 |
| logSw: | -2.622 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.877 |
| InChI Key: | KOYQGGDYQUPCKZ-GCJKJVERSA-N |