3-bromo-N-(2,4-dimethylphenyl)-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
3-bromo-N-(2,4-dimethylphenyl)-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
3-bromo-N-(2,4-dimethylphenyl)-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0199 |
| Compound Name: | 3-bromo-N-(2,4-dimethylphenyl)-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 372.22 |
| Molecular Formula: | C16 H14 Br N5 O |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c(ccc(n1)n1cnnc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4798 |
| logD: | 3.4784 |
| logSw: | -3.564 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.513 |
| InChI Key: | XOHYQNVUBOPHMR-UHFFFAOYSA-N |