N-(5-ethyl-1,3,4-thiadiazol-2-yl)-8-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-8-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-8-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D538-0177 |
| Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-8-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 315.35 |
| Molecular Formula: | C15 H13 N3 O3 S |
| Smiles: | [H]N(C(C1=CC(c2cccc(C)c2O1)=O)=O)c1nnc(CC)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.2849 |
| logD: | 2.8321 |
| logSw: | -3.7439 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.872 |
| InChI Key: | XNQPTJUCNHMBHS-UHFFFAOYSA-N |