4-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)phenyl furan-2-carboxylate
Chemical Structure Depiction of
4-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)phenyl furan-2-carboxylate
4-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)phenyl furan-2-carboxylate
Compound characteristics
| Compound ID: | Y070-0428 |
| Compound Name: | 4-({3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)phenyl furan-2-carboxylate |
| Molecular Weight: | 495.57 |
| Molecular Formula: | C25 H21 N O6 S2 |
| Smiles: | COc1ccc(CCN2C(/C(=C/c3ccc(cc3)OC(c3ccco3)=O)SC2=S)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.2476 |
| logD: | 4.2476 |
| logSw: | -4.3726 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 60.638 |
| InChI Key: | LHYSCBBTYFAHQR-UHFFFAOYSA-N |