N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-fluorophenoxy)acetamide
Chemical Structure Depiction of
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-fluorophenoxy)acetamide
N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-fluorophenoxy)acetamide
Compound characteristics
Compound ID: | F938-0523 |
Compound Name: | N-{2-[(3-bromo-1-ethyl-1H-1,2,4-triazol-5-yl)sulfanyl]phenyl}-2-(4-fluorophenoxy)acetamide |
Molecular Weight: | 451.32 |
Molecular Formula: | C18 H16 Br F N4 O2 S |
Smiles: | CCn1c(nc(n1)[Br])Sc1ccccc1NC(COc1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 3.8728 |
logD: | 3.8728 |
logSw: | -3.864 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.71 |
InChI Key: | XLRIWZVQNKDEQE-UHFFFAOYSA-N |