ethyl 4-(2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
ethyl 4-(2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Compound characteristics
Compound ID: | 4514-1281 |
Compound Name: | ethyl 4-(2-{3-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate |
Molecular Weight: | 591.68 |
Molecular Formula: | C31 H33 N3 O7 S |
Smiles: | CCOC(c1ccc(cc1)NC(CC1C(N(C(N1CCc1ccc(c(c1)OC)OC)=S)c1ccc(cc1)OC)=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1178 |
logD: | 4.1175 |
logSw: | -4.2619 |
Hydrogen bond acceptors count: | 12 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.934 |
InChI Key: | AFKCBZKHWSETJX-RUZDIDTESA-N |