N-[4-(benzylcarbamoyl)phenyl]-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
N-[4-(benzylcarbamoyl)phenyl]-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
N-[4-(benzylcarbamoyl)phenyl]-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0287 |
| Compound Name: | N-[4-(benzylcarbamoyl)phenyl]-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 477.32 |
| Molecular Formula: | C22 H17 Br N6 O2 |
| Smiles: | C(c1ccccc1)NC(c1ccc(cc1)NC(c1c(ccc(n1)n1cnnc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2959 |
| logD: | 3.2108 |
| logSw: | -3.5913 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.624 |
| InChI Key: | HRZHSVXSJOTRMX-UHFFFAOYSA-N |