3-methyl-1-[rel-(3aR,6aR)-5-(2-methylpropanoyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
Chemical Structure Depiction of
3-methyl-1-[rel-(3aR,6aR)-5-(2-methylpropanoyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
3-methyl-1-[rel-(3aR,6aR)-5-(2-methylpropanoyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
Compound characteristics
| Compound ID: | S984-1311 |
| Compound Name: | 3-methyl-1-[rel-(3aR,6aR)-5-(2-methylpropanoyl)-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one |
| Molecular Weight: | 363.5 |
| Molecular Formula: | C20 H33 N3 O3 |
| Smiles: | CC(C)CC(N1C[C@@H]2CN(C[C@@]2(C1)C(N1CCCC1)=O)C(C(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.8857 |
| logD: | 1.8857 |
| logSw: | -1.9712 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.759 |
| InChI Key: | NAZDDLGKQYUOCL-JXFKEZNVSA-N |