1-[rel-(3aR,6aR)-5-acetyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-4-methylpentan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-5-acetyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-4-methylpentan-1-one
1-[rel-(3aR,6aR)-5-acetyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-4-methylpentan-1-one
Compound characteristics
| Compound ID: | S984-1056 |
| Compound Name: | 1-[rel-(3aR,6aR)-5-acetyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]-4-methylpentan-1-one |
| Molecular Weight: | 349.47 |
| Molecular Formula: | C19 H31 N3 O3 |
| Smiles: | CC(C)CCC(N1C[C@@H]2CN(C[C@@]2(C1)C(N1CCCC1)=O)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.348 |
| logD: | 1.348 |
| logSw: | -1.3146 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.227 |
| InChI Key: | NRLXBWHVSVGVNO-LPHOPBHVSA-N |