ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 4896-3292 |
| Compound Name: | ethyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 415.3 |
| Molecular Formula: | C16 H19 Br N2 O4 S |
| Smiles: | CCOC(C1C(c2cc(c(c(c2)[Br])O)OCC)NC(NC=1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0517 |
| logD: | 3.0297 |
| logSw: | -3.1332 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.117 |
| InChI Key: | YTXGWZYBZNQHQJ-ZDUSSCGKSA-N |