ethyl 4-(3-ethoxy-4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-ethoxy-4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(3-ethoxy-4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 8009-5652 |
| Compound Name: | ethyl 4-(3-ethoxy-4-hydroxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)O)NC(NC=1c1ccccc1)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5142 |
| logD: | 3.1535 |
| logSw: | -3.4395 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.416 |
| InChI Key: | VGFIQNWCZXGDNY-LJQANCHMSA-N |