3-(5-{[3-(4-methoxyphenyl)-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-methoxyphenyl)-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-methoxyphenyl)-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: | 4476-4628 |
| Compound Name: | 3-(5-{[3-(4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 511.64 |
| Molecular Formula: | C24 H21 N3 O4 S3 |
| Smiles: | COc1ccc(cc1)c1c(/C=C2/C(N(C3CCS(C3)(=O)=O)C(=S)S2)=O)cn(c2ccccc2)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2836 |
| logD: | 3.2836 |
| logSw: | -3.5653 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 66.277 |
| InChI Key: | DFULOXYWJWUBJJ-LJQANCHMSA-N |