N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-ethylphenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-ethylphenoxy)acetamide
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-ethylphenoxy)acetamide
Compound characteristics
| Compound ID: | F938-0516 |
| Compound Name: | N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-ethylphenoxy)acetamide |
| Molecular Weight: | 461.38 |
| Molecular Formula: | C20 H21 Br N4 O2 S |
| Smiles: | CCc1ccc(cc1)OCC(Nc1ccccc1Sc1nc(nn1CC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7744 |
| logD: | 4.7744 |
| logSw: | -4.3969 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.71 |
| InChI Key: | NWMCMSHUQXEWPX-UHFFFAOYSA-N |