rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]-2-(pyridine-3-sulfonyl)octahydrocyclopenta[c]pyrrole
Chemical Structure Depiction of
rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]-2-(pyridine-3-sulfonyl)octahydrocyclopenta[c]pyrrole
rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]-2-(pyridine-3-sulfonyl)octahydrocyclopenta[c]pyrrole
Compound characteristics
| Compound ID: | SB55-1040 |
| Compound Name: | rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]-2-(pyridine-3-sulfonyl)octahydrocyclopenta[c]pyrrole |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C17 H22 N4 O3 S |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)S(c1cccnc1)(=O)=O)c1nc(C(C)C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8695 |
| logD: | 2.8695 |
| logSw: | -2.792 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.664 |
| InChI Key: | KEADDECMOPEGLY-DYVFJYSZSA-N |