rel-(3aR,6aR)-2-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-2-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
rel-(3aR,6aR)-2-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
Compound characteristics
| Compound ID: | S988-0107 |
| Compound Name: | rel-(3aR,6aR)-2-(1,2-dimethyl-1H-imidazole-4-sulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C19 H28 N6 O4 S |
| Smiles: | Cc1nc([C@]23CN(C[C@@H]3CN(C2)S(c2cn(C)c(C)n2)(=O)=O)C2CCOCC2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.199 |
| logD: | -3.8875 |
| logSw: | -1.1332 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.978 |
| InChI Key: | OZGVJWAEVIKLSD-BEFAXECRSA-N |