3-{[2-oxo-5-(piperidine-1-sulfonyl)pyridin-1(2H)-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[2-oxo-5-(piperidine-1-sulfonyl)pyridin-1(2H)-yl]methyl}benzonitrile
3-{[2-oxo-5-(piperidine-1-sulfonyl)pyridin-1(2H)-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | P511-0099 |
| Compound Name: | 3-{[2-oxo-5-(piperidine-1-sulfonyl)pyridin-1(2H)-yl]methyl}benzonitrile |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C18 H19 N3 O3 S |
| Smiles: | C1CCN(CC1)S(C1C=CC(N(Cc2cccc(C#N)c2)C=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2502 |
| logD: | 1.2502 |
| logSw: | -2.2875 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.517 |
| InChI Key: | DHBIUCXXEODTQN-UHFFFAOYSA-N |