3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Chemical Structure Depiction of
3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide
Compound characteristics
| Compound ID: | 4277-0198 |
| Compound Name: | 3-{4-[2-(2-chlorophenoxy)ethoxy]phenyl}-2-cyano-N~1~-(5-methyl-1,3,4-thiadiazol-2-yl)acrylamide |
| Molecular Weight: | 440.91 |
| Molecular Formula: | C21 H17 Cl N4 O3 S |
| Smiles: | Cc1nnc(NC(C(=C/c2ccc(cc2)OCCOc2ccccc2[Cl])\C#N)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.27 |
| logD: | 2.32 |
| logSw: | -5.21 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 166.25 |
| InChI Key: | NZWWMIPDMMOOMM-UHFFFAOYSA-N |