3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]propan-1-one
Chemical Structure Depiction of
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]propan-1-one
3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]propan-1-one
Compound characteristics
| Compound ID: | S985-0067 |
| Compound Name: | 3-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[rel-(3aR,6aR)-5-methyl-3a-(pyrrolidine-1-carbonyl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]propan-1-one |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C20 H30 N4 O3 |
| Smiles: | Cc1c(CCC(N2C[C@@H]3CN(C)C[C@@]3(C2)C(N2CCCC2)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7842 |
| logD: | -4.8896 |
| logSw: | -0.3506 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.275 |
| InChI Key: | VUFSNFPFPSEJPV-JXFKEZNVSA-N |