{5-[(3-bromo-4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(3-bromo-4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(3-bromo-4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 3229-2400 |
| Compound Name: | {5-[(3-bromo-4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 376.22 |
| Molecular Formula: | C12 H7 Br F N O3 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2ccc(c(c2)[Br])F)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8225 |
| logD: | -1.2965 |
| logSw: | -2.4921 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.098 |
| InChI Key: | DHSMBGJDULABKJ-UHFFFAOYSA-N |