3-{4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-sulfonyl}benzonitrile
Chemical Structure Depiction of
3-{4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-sulfonyl}benzonitrile
3-{4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-sulfonyl}benzonitrile
Compound characteristics
| Compound ID: | F126-0221 |
| Compound Name: | 3-{4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-sulfonyl}benzonitrile |
| Molecular Weight: | 361.5 |
| Molecular Formula: | C19 H27 N3 O2 S |
| Smiles: | CC1CCN(CC1)CC1CCN(CC1)S(c1cccc(C#N)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1258 |
| logD: | 0.3239 |
| logSw: | -3.4017 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.738 |
| InChI Key: | HJXRLQMSBWVABL-UHFFFAOYSA-N |