N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | J016-0151 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 366.37 |
| Molecular Formula: | C19 H18 N4 O4 |
| Smiles: | Cc1ccc(c(c1)n1cnnc1)OCC(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4905 |
| logD: | 1.4904 |
| logSw: | -2.1627 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.256 |
| InChI Key: | JIMURUSLHFAPIF-UHFFFAOYSA-N |