1-(4-{[rel-(1R,5S)-8-(methanesulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-(4-{[rel-(1R,5S)-8-(methanesulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-phenoxyethan-1-one
1-(4-{[rel-(1R,5S)-8-(methanesulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | SB48-0257 |
| Compound Name: | 1-(4-{[rel-(1R,5S)-8-(methanesulfonyl)-8-azabicyclo[3.2.1]octan-3-yl]oxy}piperidin-1-yl)-2-phenoxyethan-1-one |
| Molecular Weight: | 422.54 |
| Molecular Formula: | C21 H30 N2 O5 S |
| Smiles: | CS(N1[C@H]2CC[C@@H]1C[C@H](C2)OC1CCN(CC1)C(COc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.0763 |
| logD: | 0.0763 |
| logSw: | -1.978 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.535 |
| InChI Key: | YWFNTEOQPIDISM-YRWFTTLQSA-N |