4-{4-[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]piperidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
4-{4-[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]piperidine-1-sulfonyl}benzonitrile
4-{4-[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]piperidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | S698-0584 |
| Compound Name: | 4-{4-[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]piperidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 414.53 |
| Molecular Formula: | C21 H26 N4 O3 S |
| Smiles: | Cc1cnc(C2CCOCC2)n1C1CCN(CC1)S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7084 |
| logD: | 1.3943 |
| logSw: | -2.7664 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.404 |
| InChI Key: | CGQBRTIOYZBUPR-UHFFFAOYSA-N |