methyl 4-[2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 4-[2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
methyl 4-[2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Compound characteristics
Compound ID: | 8007-0751 |
Compound Name: | methyl 4-[2-(2-ethoxy-2-oxoethoxy)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate |
Molecular Weight: | 364.42 |
Molecular Formula: | C17 H20 N2 O5 S |
Smiles: | CCOC(COc1ccccc1C1C(=C(C)NC(N1)=S)C(=O)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0027 |
logD: | 1.9867 |
logSw: | -2.4801 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.593 |
InChI Key: | CWAJRCIFVOVRAR-OAHLLOKOSA-N |