N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]acetamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]acetamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]acetamide
Compound characteristics
| Compound ID: | H024-0128 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-2-[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]acetamide |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | CCOc1ccc(CCNC(Cc2nnc(c3ccncc3)[nH]2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 0.7748 |
| logD: | 0.742 |
| logSw: | -1.3363 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.904 |
| InChI Key: | QTRNQDHYIQUARD-UHFFFAOYSA-N |