4,6-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
Chemical Structure Depiction of
4,6-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
4,6-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8004-2068 |
| Compound Name: | 4,6-dimethyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile |
| Molecular Weight: | 296.39 |
| Molecular Formula: | C17 H16 N2 O S |
| Smiles: | Cc1ccc(cc1)C(CSc1c(C#N)c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7097 |
| logD: | 3.7097 |
| logSw: | -4.0998 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.824 |
| InChI Key: | DYBMSMVTKGRERX-UHFFFAOYSA-N |