3-methyl-1-[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
Chemical Structure Depiction of
3-methyl-1-[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
3-methyl-1-[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one
Compound characteristics
| Compound ID: | S988-0118 |
| Compound Name: | 3-methyl-1-[rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl]butan-1-one |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C19 H30 N4 O3 |
| Smiles: | CC(C)CC(N1C[C@H]2CN(C[C@]2(C1)c1nc(C)no1)C1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4905 |
| logD: | -4.3233 |
| logSw: | -1.5359 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.309 |
| InChI Key: | JGNHFXWNRCFPJG-BEFAXECRSA-N |