1-[rel-(3aR,6aR)-5-(1-methyl-1H-pyrrole-2-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-5-(1-methyl-1H-pyrrole-2-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
1-[rel-(3aR,6aR)-5-(1-methyl-1H-pyrrole-2-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | S985-0368 |
| Compound Name: | 1-[rel-(3aR,6aR)-5-(1-methyl-1H-pyrrole-2-carbonyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]ethan-1-one |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C19 H26 N4 O3 |
| Smiles: | CC(N1C[C@H]2CN(C[C@]2(C1)C(N1CCCC1)=O)C(c1cccn1C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0325 |
| logD: | 1.0325 |
| logSw: | -1.7686 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.9 |
| InChI Key: | WKNSVMQVKVQDEP-BEFAXECRSA-N |