4-{4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidine-1-sulfonyl}benzonitrile
4-{4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | S743-0261 |
| Compound Name: | 4-{4-[rel-(2R,3S)-3-methoxy-4-oxo-1-(propan-2-yl)azetidin-2-yl]piperidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 391.49 |
| Molecular Formula: | C19 H25 N3 O4 S |
| Smiles: | CC(C)N1C([C@@H]([C@@H]1C1CCN(CC1)S(c1ccc(C#N)cc1)(=O)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6439 |
| logD: | 1.6439 |
| logSw: | -2.479 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.957 |
| InChI Key: | ZGPZSEUGRAPJIG-QZTJIDSGSA-N |