{5-[(3,5-dibromo-2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(3,5-dibromo-2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(3,5-dibromo-2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 3229-2174 |
| Compound Name: | {5-[(3,5-dibromo-2-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 467.15 |
| Molecular Formula: | C13 H9 Br2 N O4 S2 |
| Smiles: | COc1c(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)cc(cc1[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.952 |
| logD: | -0.167 |
| logSw: | -3.0977 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.815 |
| InChI Key: | PSDNHRCSAGMHME-UHFFFAOYSA-N |