octyl {[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
octyl {[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetate
octyl {[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8014-4788 |
| Compound Name: | octyl {[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C29 H32 N2 O3 S |
| Smiles: | CCCCCCCCOC(CSc1c(C#N)c(cc(c2ccccc2)n1)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 8.7046 |
| logD: | 8.7046 |
| logSw: | -5.757 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.495 |
| InChI Key: | UBSGUVUAKNPLKL-UHFFFAOYSA-N |