methyl {4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenoxy}acetate
Chemical Structure Depiction of
methyl {4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenoxy}acetate
methyl {4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenoxy}acetate
Compound characteristics
| Compound ID: | 4490-1919 |
| Compound Name: | methyl {4-[(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenoxy}acetate |
| Molecular Weight: | 443.54 |
| Molecular Formula: | C22 H21 N O5 S2 |
| Smiles: | CCOc1cc(\C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)ccc1OCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5292 |
| logD: | 3.5292 |
| logSw: | -3.7133 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 51.817 |
| InChI Key: | XEBDXICTABNSOF-UHFFFAOYSA-N |