rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]octahydrocyclopenta[c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]octahydrocyclopenta[c]pyrrole
rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]octahydrocyclopenta[c]pyrrole
Compound characteristics
| Compound ID: | SB55-0334 |
| Compound Name: | rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]octahydrocyclopenta[c]pyrrole |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C17 H24 N4 O4 S |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)S(c1c(C)noc1C)(=O)=O)c1nc(C(C)C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7166 |
| logD: | 2.7166 |
| logSw: | -2.974 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.184 |
| InChI Key: | PCEBHUAQRLGWCD-DYVFJYSZSA-N |