2-({2-ethoxy-4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Chemical Structure Depiction of
2-({2-ethoxy-4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
2-({2-ethoxy-4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile
Compound characteristics
| Compound ID: | 3584-0555 |
| Compound Name: | 2-({2-ethoxy-4-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}methyl)benzonitrile |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C22 H20 N2 O3 S2 |
| Smiles: | CCN1C(/C(=C\c2ccc(c(c2)OCC)OCc2ccccc2C#N)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9821 |
| logD: | 3.9821 |
| logSw: | -4.1397 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.019 |
| InChI Key: | HJCBGQWSZFYMIW-UHFFFAOYSA-N |