2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-nitrophenyl)acetamide
2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 3627-0188 |
| Compound Name: | 2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-nitrophenyl)acetamide |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C17 H15 N3 O4 S2 |
| Smiles: | CCOc1ccc2c(c1)sc(n2)SCC(Nc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3898 |
| logD: | 4.3783 |
| logSw: | -4.3008 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.704 |
| InChI Key: | HXUGMKZYNNQLCR-UHFFFAOYSA-N |