ethyl 4-(2,3-dimethoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-(2,3-dimethoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,3-dimethoxyphenyl)-6-phenyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 3184-0518 |
Compound Name: | ethyl 4-(2,3-dimethoxyphenyl)-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(c2cccc(c2OC)OC)NC(NC=1c1ccccc1)=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6163 |
logD: | 3.2555 |
logSw: | -3.7543 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 59.005 |
InChI Key: | YKDDWYICERFANX-GOSISDBHSA-N |