2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide
Chemical Structure Depiction of
2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide
2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide
Compound characteristics
| Compound ID: | J016-0385 |
| Compound Name: | 2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-(4-iodophenyl)acetamide |
| Molecular Weight: | 448.26 |
| Molecular Formula: | C18 H17 I N4 O2 |
| Smiles: | CCc1ccc(c(c1)n1cnnc1)OCC(Nc1ccc(cc1)I)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2025 |
| logD: | 4.2022 |
| logSw: | -4.2754 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.433 |
| InChI Key: | PWGSHNNCMKMBDT-UHFFFAOYSA-N |