2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C354-0826 |
| Compound Name: | 2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(ethylsulfanyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 401.29 |
| Molecular Formula: | C14 H10 Cl2 N4 O2 S2 |
| Smiles: | CCSc1nc(NC(C(=C/c2cc(c(c(c2)[Cl])O)[Cl])\C#N)=O)sn1 |
| Stereo: | ACHIRAL |
| logP: | 5.33 |
| logD: | 4.66 |
| logSw: | -5.73 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 189.87 |
| InChI Key: | YJJPVOVCFRFBEV-UHFFFAOYSA-N |