rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(thiophene-2-sulfonyl)octahydropyrrolo[3,4-c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(thiophene-2-sulfonyl)octahydropyrrolo[3,4-c]pyrrole
rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(thiophene-2-sulfonyl)octahydropyrrolo[3,4-c]pyrrole
Compound characteristics
| Compound ID: | S988-1046 |
| Compound Name: | rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-(thiophene-2-sulfonyl)octahydropyrrolo[3,4-c]pyrrole |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C15 H20 N4 O5 S3 |
| Smiles: | CCS(N1C[C@@H]2CN(C[C@@]2(C1)c1nc(C)no1)S(c1cccs1)(=O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9056 |
| logD: | 0.9056 |
| logSw: | -2.0781 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 96.329 |
| InChI Key: | XOZPCKSPAIFQKX-DOMZBBRYSA-N |