2-(4-fluorophenoxy)-1-[rel-(1R,5S)-3-{[1-(methanesulfonyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenoxy)-1-[rel-(1R,5S)-3-{[1-(methanesulfonyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]ethan-1-one
2-(4-fluorophenoxy)-1-[rel-(1R,5S)-3-{[1-(methanesulfonyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]ethan-1-one
Compound characteristics
| Compound ID: | SB48-0914 |
| Compound Name: | 2-(4-fluorophenoxy)-1-[rel-(1R,5S)-3-{[1-(methanesulfonyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]ethan-1-one |
| Molecular Weight: | 440.53 |
| Molecular Formula: | C21 H29 F N2 O5 S |
| Smiles: | CS(N1CCC(CC1)O[C@H]1C[C@@H]2CC[C@H](C1)N2C(COc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2918 |
| logD: | 0.2918 |
| logSw: | -2.0843 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.981 |
| InChI Key: | ZOPCBXQMCHTRCR-IRXDYDNUSA-N |