4-({4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}methyl)benzonitrile
Chemical Structure Depiction of
4-({4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}methyl)benzonitrile
4-({4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}methyl)benzonitrile
Compound characteristics
| Compound ID: | S743-0156 |
| Compound Name: | 4-({4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}methyl)benzonitrile |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C20 H27 N3 O2 |
| Smiles: | CC(C)N1C([C@@H]([C@@H]1C1CCN(CC1)Cc1ccc(C#N)cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.912 |
| logD: | 0.8125 |
| logSw: | -2.2457 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.978 |
| InChI Key: | XBIDAFGZELXBHN-MOPGFXCFSA-N |