4-(4-{[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]methyl}piperidine-1-sulfonyl)benzonitrile
Chemical Structure Depiction of
4-(4-{[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]methyl}piperidine-1-sulfonyl)benzonitrile
4-(4-{[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]methyl}piperidine-1-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | S697-0539 |
| Compound Name: | 4-(4-{[5-methyl-2-(oxan-4-yl)-1H-imidazol-1-yl]methyl}piperidine-1-sulfonyl)benzonitrile |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C22 H28 N4 O3 S |
| Smiles: | Cc1cnc(C2CCOCC2)n1CC1CCN(CC1)S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1534 |
| logD: | 2.3696 |
| logSw: | -3.0073 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.02 |
| InChI Key: | LUMSTQYPLMNLQW-UHFFFAOYSA-N |