1-(4-{[rel-(1R,5S)-8-acetyl-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{[rel-(1R,5S)-8-acetyl-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one
1-(4-{[rel-(1R,5S)-8-acetyl-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | SB48-0135 |
| Compound Name: | 1-(4-{[rel-(1R,5S)-8-acetyl-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 376.52 |
| Molecular Formula: | C20 H28 N2 O3 S |
| Smiles: | CC(N1[C@H]2CC[C@@H]1C[C@H](C2)OC1CCN(CC1)C(Cc1cccs1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1904 |
| logD: | 0.1904 |
| logSw: | -1.8356 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.413 |
| InChI Key: | PXCMZDACSBWXHR-HOTGVXAUSA-N |