2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-ethyl-4,6-dimethylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-ethyl-4,6-dimethylpyridine-3-carbonitrile
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-ethyl-4,6-dimethylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8009-6325 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-5-ethyl-4,6-dimethylpyridine-3-carbonitrile |
| Molecular Weight: | 344.86 |
| Molecular Formula: | C18 H17 Cl N2 O S |
| Smiles: | CCc1c(C)c(C#N)c(nc1C)SCC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9718 |
| logD: | 4.9718 |
| logSw: | -5.3152 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.594 |
| InChI Key: | QLPCEXUROOKWDS-UHFFFAOYSA-N |