3-(5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-(5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
3-(5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | 3541-0211 |
| Compound Name: | 3-(5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 499.6 |
| Molecular Formula: | C23 H18 F N3 O3 S3 |
| Smiles: | C1CS(CC1N1C(/C(=C/c2cn(c3ccccc3)nc2c2ccc(cc2)F)SC1=S)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3303 |
| logD: | 3.3303 |
| logSw: | -3.5842 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 58.734 |
| InChI Key: | VBUPOIGBWXIZNG-LJQANCHMSA-N |