2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{2-[2-(4-methylphenoxy)ethoxy]phenyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{2-[2-(4-methylphenoxy)ethoxy]phenyl}acrylamide
2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{2-[2-(4-methylphenoxy)ethoxy]phenyl}acrylamide
Compound characteristics
Compound ID: | 3537-5239 |
Compound Name: | 2-cyano-N~1~-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-{2-[2-(4-methylphenoxy)ethoxy]phenyl}acrylamide |
Molecular Weight: | 434.52 |
Molecular Formula: | C23 H22 N4 O3 S |
Smiles: | CCc1nnc(NC(C(=C/c2ccccc2OCCOc2ccc(C)cc2)\C#N)=O)s1 |
Stereo: | ACHIRAL |
logP: | 5.31 |
logD: | 3.68 |
logSw: | -6.16 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 151.99 |
InChI Key: | WFNSIYNDMMAMMD-UHFFFAOYSA-N |