ethyl 4-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
Chemical Structure Depiction of
ethyl 4-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
ethyl 4-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate
Compound characteristics
| Compound ID: | 3453-0486 |
| Compound Name: | ethyl 4-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinane-5-carboxylate |
| Molecular Weight: | 394.37 |
| Molecular Formula: | C15 H17 F3 N2 O5 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)O)NC(NC1(C(F)(F)F)O)=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.7581 |
| logD: | 1.7533 |
| logSw: | -2.4181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 85.07 |
| InChI Key: | FOVJPTLXAWJHNY-UHFFFAOYSA-N |