N-(2,1,3-benzothiadiazol-4-yl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Chemical Structure Depiction of
N-(2,1,3-benzothiadiazol-4-yl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
N-(2,1,3-benzothiadiazol-4-yl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | J016-0402 |
| Compound Name: | N-(2,1,3-benzothiadiazol-4-yl)-2-[4-ethyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]acetamide |
| Molecular Weight: | 380.43 |
| Molecular Formula: | C18 H16 N6 O2 S |
| Smiles: | CCc1ccc(c(c1)n1cnnc1)OCC(Nc1cccc2c1nsn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0227 |
| logD: | 3.0224 |
| logSw: | -3.3396 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.688 |
| InChI Key: | YBYZTIMELIBNKV-UHFFFAOYSA-N |