ethyl {4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
Chemical Structure Depiction of
ethyl {4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
ethyl {4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate
Compound characteristics
| Compound ID: | 3448-2119 |
| Compound Name: | ethyl {4-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy}acetate |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C21 H18 N2 O4 S |
| Smiles: | CCOC(COc1ccc(\C=C(/C#N)c2nc3ccccc3s2)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9877 |
| logD: | 3.9877 |
| logSw: | -4.1473 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.118 |
| InChI Key: | GWJYHQKKQXNAGV-UHFFFAOYSA-N |