3-(2-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
Chemical Structure Depiction of
3-(2-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
3-(2-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one
Compound characteristics
| Compound ID: | SB55-0396 |
| Compound Name: | 3-(2-methoxyphenyl)-1-[rel-(3aR,6aR)-3a-[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]hexahydrocyclopenta[c]pyrrol-2(1H)-yl]propan-1-one |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C22 H29 N3 O3 |
| Smiles: | [H][C@@]12CCC[C@]2(CN(C1)C(CCc1ccccc1OC)=O)c1nc(C(C)C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.3734 |
| logD: | 4.3734 |
| logSw: | -4.3588 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.187 |
| InChI Key: | XLSBURJADQGJGX-VGSWGCGISA-N |