ethyl 4-[4-(benzoyloxy)-3-ethoxyphenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(benzoyloxy)-3-ethoxyphenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-[4-(benzoyloxy)-3-ethoxyphenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | 3339-3861 |
| Compound Name: | ethyl 4-[4-(benzoyloxy)-3-ethoxyphenyl]-1,6-dimethyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
| Molecular Weight: | 454.54 |
| Molecular Formula: | C24 H26 N2 O5 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OC(c2ccccc2)=O)NC(N(C)C=1C)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7126 |
| logD: | 3.7126 |
| logSw: | -4.0358 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.941 |
| InChI Key: | RLKZZAAZWIOWNQ-OAQYLSRUSA-N |