N-(3-bromophenyl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-(3-bromophenyl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-(3-bromophenyl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | J016-0381 |
| Compound Name: | N-(3-bromophenyl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 401.26 |
| Molecular Formula: | C18 H17 Br N4 O2 |
| Smiles: | CCc1ccc(c(c1)n1cnnc1)OCC(Nc1cccc(c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7999 |
| logD: | 3.7996 |
| logSw: | -3.9775 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.433 |
| InChI Key: | DOBJEQDZTJWSOU-UHFFFAOYSA-N |