ethyl 4-hydroxy-6-(4-hydroxy-3,5-dimethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
Chemical Structure Depiction of
ethyl 4-hydroxy-6-(4-hydroxy-3,5-dimethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
ethyl 4-hydroxy-6-(4-hydroxy-3,5-dimethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
Compound characteristics
| Compound ID: | 3453-0499 |
| Compound Name: | ethyl 4-hydroxy-6-(4-hydroxy-3,5-dimethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate |
| Molecular Weight: | 424.39 |
| Molecular Formula: | C16 H19 F3 N2 O6 S |
| Smiles: | CCOC(C1C(c2cc(c(c(c2)OC)O)OC)NC(NC1(C(F)(F)F)O)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5457 |
| logD: | 1.5358 |
| logSw: | -2.3469 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 91.632 |
| InChI Key: | VGRRTQSRLPQMAO-UHFFFAOYSA-N |