2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
Chemical Structure Depiction of
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide
Compound characteristics
| Compound ID: | C146-1068 |
| Compound Name: | 2-cyano-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]-3-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}acrylamide |
| Molecular Weight: | 512.61 |
| Molecular Formula: | C24 H24 N4 O5 S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2ccc(c(c2)OC)OCCOc2ccccc2OC)\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 4.72 |
| logD: | 4.05 |
| logSw: | -5.19 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 204.51 |
| InChI Key: | CAMUFUJQAKKPGX-UHFFFAOYSA-N |