1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(2-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(2-methylphenyl)ethan-1-one
1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(2-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SB55-1184 |
| Compound Name: | 1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-2-(2-methylphenyl)ethan-1-one |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C20 H25 N3 O2 |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)C(Cc1ccccc1C)=O)c1nc(CC)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1799 |
| logD: | 4.1799 |
| logSw: | -4.0275 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.222 |
| InChI Key: | USPDJZOFVNPIQS-UZLBHIALSA-N |