3-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
3-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 3797-0411 |
| Compound Name: | 3-{4-[(2-chlorobenzyl)oxy]-3-ethoxyphenyl}-2-cyano-N~1~-(5-propyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 482.99 |
| Molecular Formula: | C24 H23 Cl N4 O3 S |
| Smiles: | CCCc1nnc(NC(C(=C/c2ccc(c(c2)OCC)OCc2ccccc2[Cl])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.54 |
| logD: | 3.61 |
| logSw: | -6.25 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 152.63 |
| InChI Key: | ACAGCGPGAFEKOV-UHFFFAOYSA-N |