rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-(5-phenyl-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-phenyl-1,2,4-oxadiazol-3-yl)octahydrocyclopenta[c]pyrrole
rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-(5-phenyl-1,2,4-oxadiazol-3-yl)octahydrocyclopenta[c]pyrrole
Compound characteristics
| Compound ID: | SB55-0905 |
| Compound Name: | rel-(3aR,6aR)-2-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-3a-(5-phenyl-1,2,4-oxadiazol-3-yl)octahydrocyclopenta[c]pyrrole |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C20 H22 N4 O4 S |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)S(c1c(C)noc1C)(=O)=O)c1nc(c2ccccc2)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9978 |
| logD: | 2.9978 |
| logSw: | -3.1567 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.913 |
| InChI Key: | HEARQZAEBZJSLO-UZLBHIALSA-N |