1-[rel-(1R,5S)-3-{[1-(2-methylpropyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(1R,5S)-3-{[1-(2-methylpropyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]-2-(thiophen-3-yl)ethan-1-one
1-[rel-(1R,5S)-3-{[1-(2-methylpropyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | SB48-0632 |
| Compound Name: | 1-[rel-(1R,5S)-3-{[1-(2-methylpropyl)piperidin-4-yl]oxy}-8-azabicyclo[3.2.1]octan-8-yl]-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 390.59 |
| Molecular Formula: | C22 H34 N2 O2 S |
| Smiles: | CC(C)CN1CCC(CC1)O[C@H]1C[C@@H]2CC[C@H](C1)N2C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0724 |
| logD: | -0.4135 |
| logSw: | -2.2732 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.0294 |
| InChI Key: | HBHQNYCMDNKHEJ-KXTWHKPSSA-N |