1-[rel-(3aR,6aR)-5-(morpholine-4-sulfonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-5-(morpholine-4-sulfonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
1-[rel-(3aR,6aR)-5-(morpholine-4-sulfonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S984-1136 |
| Compound Name: | 1-[rel-(3aR,6aR)-5-(morpholine-4-sulfonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C17 H28 N4 O5 S |
| Smiles: | CC(N1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.7549 |
| logD: | -0.7549 |
| logSw: | -1.0239 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.86 |
| InChI Key: | AVXNHSVDEIBVOS-WBVHZDCISA-N |