2-cyano-3-{3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-{3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-{3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 4272-0358 |
| Compound Name: | 2-cyano-3-{3-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}-N~1~-[5-(2-methylphenyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 526.61 |
| Molecular Formula: | C29 H26 N4 O4 S |
| Smiles: | Cc1ccccc1c1nnc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccccc2C)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.14 |
| logD: | 6.12 |
| logSw: | -7.1 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 157.48 |
| InChI Key: | VUQQOKTVJUCMJG-UHFFFAOYSA-N |