6-ethyl-5-methyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
Chemical Structure Depiction of
6-ethyl-5-methyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
6-ethyl-5-methyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8001-8250 |
| Compound Name: | 6-ethyl-5-methyl-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3-carbonitrile |
| Molecular Weight: | 310.42 |
| Molecular Formula: | C18 H18 N2 O S |
| Smiles: | CCc1c(C)cc(C#N)c(n1)SCC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4171 |
| logD: | 4.4171 |
| logSw: | -4.3252 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.283 |
| InChI Key: | FDJVJNNJXDVRGC-UHFFFAOYSA-N |