N-[(3,4-dimethoxyphenyl)methyl]-2-[3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-[3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-[3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetamide
Compound characteristics
| Compound ID: | P496-0892 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-[3-(pyridin-2-yl)-1H-1,2,4-triazol-5-yl]acetamide |
| Molecular Weight: | 353.38 |
| Molecular Formula: | C18 H19 N5 O3 |
| Smiles: | COc1ccc(CNC(Cc2nc(c3ccccn3)n[nH]2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.1948 |
| logD: | 1.1911 |
| logSw: | -2.0204 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.522 |
| InChI Key: | YRTCEMLDJGUSKG-UHFFFAOYSA-N |