ethyl {[3-cyano-6-{4-[(prop-2-en-1-yl)oxy]phenyl}-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[3-cyano-6-{4-[(prop-2-en-1-yl)oxy]phenyl}-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate
ethyl {[3-cyano-6-{4-[(prop-2-en-1-yl)oxy]phenyl}-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 6187-1209 |
| Compound Name: | ethyl {[3-cyano-6-{4-[(prop-2-en-1-yl)oxy]phenyl}-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetate |
| Molecular Weight: | 422.42 |
| Molecular Formula: | C20 H17 F3 N2 O3 S |
| Smiles: | CCOC(CSc1c(C#N)c(cc(c2ccc(cc2)OCC=C)n1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5396 |
| logD: | 5.5396 |
| logSw: | -5.5292 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.347 |
| InChI Key: | MPLVFOLTDKQLFS-UHFFFAOYSA-N |