N-{5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}pyridine-2-carboxamide
Chemical Structure Depiction of
N-{5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}pyridine-2-carboxamide
N-{5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}pyridine-2-carboxamide
Compound characteristics
| Compound ID: | Y042-5351 |
| Compound Name: | N-{5-[(4-methoxyphenyl)methyl]-4H-1,2,4-triazol-3-yl}pyridine-2-carboxamide |
| Molecular Weight: | 309.33 |
| Molecular Formula: | C16 H15 N5 O2 |
| Smiles: | COc1ccc(Cc2nnc(NC(c3ccccn3)=O)[nH]2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.2345 |
| logD: | 1.0979 |
| logSw: | -1.8251 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.831 |
| InChI Key: | KYDFBKHLWXMBCK-UHFFFAOYSA-N |