N-(2,1,3-benzothiadiazol-4-yl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
N-(2,1,3-benzothiadiazol-4-yl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
N-(2,1,3-benzothiadiazol-4-yl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0220 |
| Compound Name: | N-(2,1,3-benzothiadiazol-4-yl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 402.23 |
| Molecular Formula: | C14 H8 Br N7 O S |
| Smiles: | c1cc(c2c(c1)nsn2)NC(c1c(ccc(n1)n1cnnc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.028 |
| logD: | 2.9762 |
| logSw: | -3.4428 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.466 |
| InChI Key: | OZOXPGSHJMKUQJ-UHFFFAOYSA-N |