N-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
N-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D468-2061 |
| Compound Name: | N-(2,1,3-benzothiadiazol-5-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 323.33 |
| Molecular Formula: | C16 H9 N3 O3 S |
| Smiles: | [H]N(C(C1=CC(c2ccccc2O1)=O)=O)c1ccc2c(c1)nsn2 |
| Stereo: | ACHIRAL |
| logP: | 3.3661 |
| logD: | 3.3095 |
| logSw: | -4.0127 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.33 |
| InChI Key: | GGYPHLPSTXJBOP-UHFFFAOYSA-N |