1-{rel-(1R,5S)-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{rel-(1R,5S)-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}-2-(3-methylphenoxy)ethan-1-one
1-{rel-(1R,5S)-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | S253-0299 |
| Compound Name: | 1-{rel-(1R,5S)-3-[3-(2-methoxyethyl)-1,2,4-oxadiazol-5-yl]-8-azabicyclo[3.2.1]octan-8-yl}-2-(3-methylphenoxy)ethan-1-one |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C21 H27 N3 O4 |
| Smiles: | Cc1cccc(c1)OCC(N1[C@H]2CC[C@@H]1C[C@H](C2)c1nc(CCOC)no1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.352 |
| logD: | 2.352 |
| logSw: | -2.5659 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.741 |
| InChI Key: | JSAOVLBZKJRLFT-BJWYYQGGSA-N |