2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile
2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile
Compound characteristics
Compound ID: | 4378-0147 |
Compound Name: | 2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-6-(4-methylphenyl)-4-phenylpyridine-3-carbonitrile |
Molecular Weight: | 422.57 |
Molecular Formula: | C23 H22 N2 O2 S2 |
Smiles: | CCS(CCSc1c(C#N)c(cc(c2ccc(C)cc2)n1)c1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.1935 |
logD: | 5.1935 |
logSw: | -5.1985 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.799 |
InChI Key: | DWAIHGSCESRRNQ-UHFFFAOYSA-N |