ethyl {[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
ethyl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate
ethyl {[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: | D140-0048 |
| Compound Name: | ethyl {[4-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)-1,1,1-trifluoro-4-oxobutan-2-yl]sulfanyl}acetate |
| Molecular Weight: | 365.37 |
| Molecular Formula: | C15 H18 F3 N O4 S |
| Smiles: | CCOC(CSC(CC(C1=C(C)C=C(C)NC1=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6245 |
| logD: | 1.4009 |
| logSw: | -2.7522 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.377 |
| InChI Key: | ZJROXQHBCAYGDN-NSHDSACASA-N |