6-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
6-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1344 |
| Compound Name: | 6-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 400.84 |
| Molecular Formula: | C19 H13 Cl N2 O4 S |
| Smiles: | CCOc1ccc2c(c1)sc(NC(C1=CC(c3cc(ccc3O1)[Cl])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 5.1726 |
| logD: | 5.1708 |
| logSw: | -5.359 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.033 |
| InChI Key: | NIAFIYNDFYSXBK-UHFFFAOYSA-N |