{5-[(3-{4-[(2-fluorophenyl)methoxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Chemical Structure Depiction of
{5-[(3-{4-[(2-fluorophenyl)methoxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
{5-[(3-{4-[(2-fluorophenyl)methoxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid
Compound characteristics
| Compound ID: | 5999-4319 |
| Compound Name: | {5-[(3-{4-[(2-fluorophenyl)methoxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl}acetic acid |
| Molecular Weight: | 545.61 |
| Molecular Formula: | C28 H20 F N3 O4 S2 |
| Smiles: | [H]C(=C1/C(N(CC(O)=O)C(=S)S1)=O)\c1cn(c2ccccc2)nc1c1ccc(cc1)OCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 4.3315 |
| logD: | 1.2125 |
| logSw: | -4.3684 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.958 |
| InChI Key: | GYAPMLCZKULZGK-UHFFFAOYSA-N |