ethyl 4-(3,4-dimethoxyphenyl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,4-dimethoxyphenyl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate
ethyl 4-(3,4-dimethoxyphenyl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate
Compound characteristics
Compound ID: | 8009-5278 |
Compound Name: | ethyl 4-(3,4-dimethoxyphenyl)-2-[(phenylcarbamothioyl)amino]thiophene-3-carboxylate |
Molecular Weight: | 442.55 |
Molecular Formula: | C22 H22 N2 O4 S2 |
Smiles: | CCOC(c1c(csc1NC(Nc1ccccc1)=S)c1ccc(c(c1)OC)OC)=O |
Stereo: | ACHIRAL |
logP: | 4.8811 |
logD: | 4.881 |
logSw: | -4.7142 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 54.598 |
InChI Key: | GIOKAVLXKDLOCR-UHFFFAOYSA-N |