propan-2-yl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
propan-2-yl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate
propan-2-yl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | D140-0049 |
| Compound Name: | propan-2-yl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate |
| Molecular Weight: | 379.4 |
| Molecular Formula: | C16 H20 F3 N O4 S |
| Smiles: | CC(C)OC(CSC(CC(C1=C(C)C=C(C)NC1=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9022 |
| logD: | 1.6786 |
| logSw: | -3.2313 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.056 |
| InChI Key: | SJEDKHKVQGGCTJ-LBPRGKRZSA-N |