N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-{3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
Chemical Structure Depiction of
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-{3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-{3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
Compound characteristics
| Compound ID: | 4272-0333 |
| Compound Name: | N~1~-(5-butyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-{3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide |
| Molecular Weight: | 522.62 |
| Molecular Formula: | C27 H30 N4 O5 S |
| Smiles: | CCCCc1nnc(NC(C(=C/c2ccc(c(c2)OCC)OCCOc2ccccc2OC)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.17 |
| logD: | 3.24 |
| logSw: | -6.18 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 167.14 |
| InChI Key: | QMOHTAWARQRGKH-UHFFFAOYSA-N |