3-{4-[rel-(2R,3R)-3-methoxy-1-(propan-2-yl)azetidin-2-yl]piperidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
3-{4-[rel-(2R,3R)-3-methoxy-1-(propan-2-yl)azetidin-2-yl]piperidine-1-carbonyl}benzonitrile
3-{4-[rel-(2R,3R)-3-methoxy-1-(propan-2-yl)azetidin-2-yl]piperidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S759-0033 |
| Compound Name: | 3-{4-[rel-(2R,3R)-3-methoxy-1-(propan-2-yl)azetidin-2-yl]piperidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C20 H27 N3 O2 |
| Smiles: | CC(C)N1C[C@@H]([C@@H]1C1CCN(CC1)C(c1cccc(C#N)c1)=O)OC |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0313 |
| logD: | -0.8768 |
| logSw: | -2.2349 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.51 |
| InChI Key: | YHVBGYCVWWLIIU-RBUKOAKNSA-N |