methyl {[5-cyano-4-oxo-2-(2-phenylethenyl)-3,4-dihydro-2H-1,3-thiazin-6-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-cyano-4-oxo-2-(2-phenylethenyl)-3,4-dihydro-2H-1,3-thiazin-6-yl]sulfanyl}acetate
methyl {[5-cyano-4-oxo-2-(2-phenylethenyl)-3,4-dihydro-2H-1,3-thiazin-6-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 7218-1439 |
| Compound Name: | methyl {[5-cyano-4-oxo-2-(2-phenylethenyl)-3,4-dihydro-2H-1,3-thiazin-6-yl]sulfanyl}acetate |
| Molecular Weight: | 346.42 |
| Molecular Formula: | C16 H14 N2 O3 S2 |
| Smiles: | COC(CSC1=C(C#N)C(NC(/C=C/c2ccccc2)S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9142 |
| logD: | 2.8522 |
| logSw: | -3.3569 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.547 |
| InChI Key: | XUUNZKXKQQRXSS-GWJCSSMESA-N |