2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoic acid
Chemical Structure Depiction of
2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoic acid
2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoic acid
Compound characteristics
| Compound ID: | 8008-7327 |
| Compound Name: | 2-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}benzoic acid |
| Molecular Weight: | 388.46 |
| Molecular Formula: | C18 H16 N2 O4 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SCC(Nc1ccccc1C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.63 |
| logD: | 0.2171 |
| logSw: | -4.2873 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.032 |
| InChI Key: | HBKYOMQMVJWNTL-UHFFFAOYSA-N |