N-(4-acetylphenyl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
N-(4-acetylphenyl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0192 |
| Compound Name: | N-(4-acetylphenyl)-3-bromo-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 386.21 |
| Molecular Formula: | C16 H12 Br N5 O2 |
| Smiles: | CC(c1ccc(cc1)NC(c1c(ccc(n1)n1cnnc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.341 |
| logD: | 2.2721 |
| logSw: | -2.9813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.038 |
| InChI Key: | ZSUAZMQZECTPFD-UHFFFAOYSA-N |