2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}acrylamide
2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}acrylamide
Compound characteristics
| Compound ID: | 4277-0865 |
| Compound Name: | 2-cyano-N~1~-(5-isobutyl-1,3,4-thiadiazol-2-yl)-3-{3-methoxy-4-[2-(4-methoxyphenoxy)ethoxy]phenyl}acrylamide |
| Molecular Weight: | 508.6 |
| Molecular Formula: | C26 H28 N4 O5 S |
| Smiles: | CC(C)Cc1nnc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccc(cc2)OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2 |
| logD: | 3.27 |
| logSw: | -6.22 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 185.69 |
| InChI Key: | ZKFYGECESNBKNW-UHFFFAOYSA-N |