rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(thiophen-2-yl)methyl]octahydropyrrolo[3,4-c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(thiophen-2-yl)methyl]octahydropyrrolo[3,4-c]pyrrole
rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(thiophen-2-yl)methyl]octahydropyrrolo[3,4-c]pyrrole
Compound characteristics
| Compound ID: | S988-0498 |
| Compound Name: | rel-(3aR,6aR)-2-(ethanesulfonyl)-3a-(3-methyl-1,2,4-oxadiazol-5-yl)-5-[(thiophen-2-yl)methyl]octahydropyrrolo[3,4-c]pyrrole |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C16 H22 N4 O3 S2 |
| Smiles: | CCS(N1C[C@@H]2CN(Cc3cccs3)C[C@@]2(C1)c1nc(C)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4394 |
| logD: | -1.3208 |
| logSw: | -2.284 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.351 |
| InChI Key: | QAYQLVVNLXVOGG-CJNGLKHVSA-N |