4-{4-[rel-(3R,4S)-3-methoxy-2-oxo-4-(pyridin-4-yl)azetidin-1-yl]piperidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[rel-(3R,4S)-3-methoxy-2-oxo-4-(pyridin-4-yl)azetidin-1-yl]piperidine-1-carbonyl}benzonitrile
4-{4-[rel-(3R,4S)-3-methoxy-2-oxo-4-(pyridin-4-yl)azetidin-1-yl]piperidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | S741-0024 |
| Compound Name: | 4-{4-[rel-(3R,4S)-3-methoxy-2-oxo-4-(pyridin-4-yl)azetidin-1-yl]piperidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C22 H22 N4 O3 |
| Smiles: | CO[C@H]1C(N(C2CCN(CC2)C(c2ccc(C#N)cc2)=O)[C@H]1c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.8978 |
| logD: | 0.8954 |
| logSw: | -1.0187 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.36 |
| InChI Key: | PWSIKBIBGXEUJN-VQTJNVASSA-N |