2-cyano-3-{4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
2-cyano-3-{4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
2-cyano-3-{4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3773-1729 |
| Compound Name: | 2-cyano-3-{4-[2-(3,4-dimethylphenoxy)ethoxy]phenyl}-N~1~-(5-isopropyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Smiles: | CC(C)c1nnc(NC(C(=C/c2ccc(cc2)OCCOc2ccc(C)c(C)c2)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.13 |
| logD: | 4.22 |
| logSw: | -6.93 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 162.17 |
| InChI Key: | FRSUZQUQYRSMBN-UHFFFAOYSA-N |