3-bromo-N-[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
3-bromo-N-[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
3-bromo-N-[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0251 |
| Compound Name: | 3-bromo-N-[4-(5-methyl-1,3-benzothiazol-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 491.37 |
| Molecular Formula: | C22 H15 Br N6 O S |
| Smiles: | Cc1ccc2c(c1)nc(c1ccc(cc1)NC(c1c(ccc(n1)n1cnnc1)[Br])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.2286 |
| logD: | 5.2283 |
| logSw: | -5.0144 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.66 |
| InChI Key: | AKTNWIFIIVDVSF-UHFFFAOYSA-N |