dimethyl 2-{[ethyl(2-hydroxyethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[ethyl(2-hydroxyethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[ethyl(2-hydroxyethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | C200-1770 |
| Compound Name: | dimethyl 2-{[ethyl(2-hydroxyethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C15 H20 N2 O5 S |
| Smiles: | CCN(CCO)C(Nc1cc(ccc1C(=O)OC)C(=O)OC)=S |
| Stereo: | ACHIRAL |
| logP: | 2.3113 |
| logD: | 2.311 |
| logSw: | -3.0874 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.98 |
| InChI Key: | SPOPRSWACOHEJV-UHFFFAOYSA-N |