2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide
Compound characteristics
| Compound ID: | C355-0085 |
| Compound Name: | 2-cyano-3-(3,5-dichloro-4-hydroxyphenyl)-N~1~-[3-(methylsulfonyl)-1,2,4-thiadiazol-5-yl]acrylamide |
| Molecular Weight: | 419.26 |
| Molecular Formula: | C13 H8 Cl2 N4 O4 S2 |
| Smiles: | CS(c1nc(NC(C(=C/c2cc(c(c(c2)[Cl])O)[Cl])\C#N)=O)sn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.26 |
| logD: | 0.91 |
| logSw: | -3.72 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 223.84 |
| InChI Key: | PDWAYLCXXLGMLU-UHFFFAOYSA-N |