3-{4-[2-(2-allylphenoxy)ethoxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{4-[2-(2-allylphenoxy)ethoxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
3-{4-[2-(2-allylphenoxy)ethoxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3797-0677 |
| Compound Name: | 3-{4-[2-(2-allylphenoxy)ethoxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 518.63 |
| Molecular Formula: | C28 H30 N4 O4 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2ccc(c(c2)OCC)OCCOc2ccccc2CC=C)\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 6 |
| logD: | 4.07 |
| logSw: | -6.67 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 149.71 |
| InChI Key: | JGXRASXYNSPJLD-UHFFFAOYSA-N |