2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-5,6-dimethylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-5,6-dimethylpyridine-3-carbonitrile
2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-5,6-dimethylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8294-0138 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-5,6-dimethylpyridine-3-carbonitrile |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C17 H16 N2 O2 S |
| Smiles: | Cc1cc(C#N)c(nc1C)SCC(c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5063 |
| logD: | 3.5063 |
| logSw: | -3.8363 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.138 |
| InChI Key: | KWCMONGUHXTNGH-UHFFFAOYSA-N |