{5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 1207-0034 |
| Compound Name: | {5-[(5-bromo-3-chloro-2-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 408.67 |
| Molecular Formula: | C12 H7 Br Cl N O4 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2cc(cc(c2O)[Cl])[Br])SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7585 |
| logD: | -0.3605 |
| logSw: | -3.1756 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.577 |
| InChI Key: | PVHVMTYHMSBZFL-UHFFFAOYSA-N |