rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[(4-methylphenyl)methanesulfonyl]-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[(4-methylphenyl)methanesulfonyl]-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[(4-methylphenyl)methanesulfonyl]-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole
Compound characteristics
| Compound ID: | S988-1312 |
| Compound Name: | rel-(3aR,6aR)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-2-[(4-methylphenyl)methanesulfonyl]-5-(oxan-4-yl)octahydropyrrolo[3,4-c]pyrrole |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C22 H30 N4 O4 S |
| Smiles: | Cc1ccc(CS(N2C[C@H]3CN(C[C@]3(C2)c2nc(C)no2)C2CCOCC2)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7802 |
| logD: | -2.4332 |
| logSw: | -2.3868 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.522 |
| InChI Key: | MINGYRHZSZKZFQ-KNQAVFIVSA-N |