6-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
6-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
6-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1268 |
| Compound Name: | 6-chloro-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 321.74 |
| Molecular Formula: | C13 H8 Cl N3 O3 S |
| Smiles: | [H]N(C(C1=CC(c2cc(ccc2O1)[Cl])=O)=O)c1nnc(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.786 |
| logD: | 1.7405 |
| logSw: | -3.7119 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.499 |
| InChI Key: | QHGVTNYGNQVETA-UHFFFAOYSA-N |