3-bromo-N-[2-hydroxy-5-(propan-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Chemical Structure Depiction of
3-bromo-N-[2-hydroxy-5-(propan-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
3-bromo-N-[2-hydroxy-5-(propan-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide
Compound characteristics
| Compound ID: | J015-0237 |
| Compound Name: | 3-bromo-N-[2-hydroxy-5-(propan-2-yl)phenyl]-6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxamide |
| Molecular Weight: | 402.25 |
| Molecular Formula: | C17 H16 Br N5 O2 |
| Smiles: | CC(C)c1ccc(c(c1)NC(c1c(ccc(n1)n1cnnc1)[Br])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.7913 |
| logD: | 3.7883 |
| logSw: | -3.5855 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.061 |
| InChI Key: | NYBLDJGNFHAQHW-UHFFFAOYSA-N |