5-{2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzene-1,3-dicarboxylic acid
Chemical Structure Depiction of
5-{2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzene-1,3-dicarboxylic acid
5-{2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzene-1,3-dicarboxylic acid
Compound characteristics
| Compound ID: | 5461-0015 |
| Compound Name: | 5-{2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamido}benzene-1,3-dicarboxylic acid |
| Molecular Weight: | 415.42 |
| Molecular Formula: | C19 H17 N3 O6 S |
| Smiles: | CCOc1ccc2c(c1)nc([nH]2)SCC(Nc1cc(cc(c1)C(O)=O)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4676 |
| logD: | 0.1042 |
| logSw: | -3.732 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 105.069 |
| InChI Key: | OPGWEOREFQXOJL-UHFFFAOYSA-N |