2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]acetamide
2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | J016-0064 |
| Compound Name: | 2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[4-(2-oxo-2H-1-benzopyran-3-yl)phenyl]acetamide |
| Molecular Weight: | 452.47 |
| Molecular Formula: | C26 H20 N4 O4 |
| Smiles: | Cc1ccc(c(c1)n1cnnc1)OCC(Nc1ccc(cc1)C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6383 |
| logD: | 3.6382 |
| logSw: | -4.066 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.083 |
| InChI Key: | ADKBXYZOYQEBTB-UHFFFAOYSA-N |