1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-3-(2-methoxyphenyl)propan-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]-3-(2-methoxyphenyl)propan-1-one
1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-3-(2-methoxyphenyl)propan-1-one
Compound characteristics
| Compound ID: | SB55-0787 |
| Compound Name: | 1-[rel-(3aR,6aR)-3a-(5-ethyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]-3-(2-methoxyphenyl)propan-1-one |
| Molecular Weight: | 369.46 |
| Molecular Formula: | C21 H27 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)C(CCc1ccccc1OC)=O)c1nc(CC)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7198 |
| logD: | 3.7198 |
| logSw: | -3.8649 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.852 |
| InChI Key: | WQCWYXBUGJODME-IERDGZPVSA-N |