3-(4-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-(5-methyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-(5-methyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
3-(4-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-(5-methyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
Compound characteristics
| Compound ID: | SB55-0259 |
| Compound Name: | 3-(4-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-(5-methyl-1,2,4-oxadiazol-3-yl)hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C20 H25 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)C(CCc1ccc(cc1)OC)=O)c1nc(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.0633 |
| logD: | 3.0633 |
| logSw: | -2.9762 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.328 |
| InChI Key: | KWSIMFUAWQYKQS-UZLBHIALSA-N |