{5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 1588-0212 |
| Compound Name: | {5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 388.26 |
| Molecular Formula: | C13 H10 Br N O4 S2 |
| Smiles: | COc1ccc(\C=C2/C(N(CC(O)=O)C(=S)S2)=O)cc1[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.601 |
| logD: | -1.518 |
| logSw: | -2.2228 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.728 |
| InChI Key: | SSZLYZCVDHZVBX-UHFFFAOYSA-N |