2-cyano-3-{4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
Compound ID: | 4277-0180 |
Compound Name: | 2-cyano-3-{4-[2-(4-methoxyphenoxy)ethoxy]phenyl}-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
Molecular Weight: | 436.49 |
Molecular Formula: | C22 H20 N4 O4 S |
Smiles: | Cc1nnc(NC(C(=C/c2ccc(cc2)OCCOc2ccc(cc2)OC)\C#N)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.92 |
logD: | 1.97 |
logSw: | -4.88 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 186.16 |
InChI Key: | RINMYNHKKUTFOY-UHFFFAOYSA-N |