3-(4-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-(4-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
3-(4-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | 2556-0804 |
| Compound Name: | 3-(4-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2-sulfanylidene-1,3-thiazolidin-3-yl)-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C21 H17 N3 O3 S4 |
| Smiles: | C1CS(CC1N1C(/C(=C/c2cn(c3ccccc3)nc2c2cccs2)SC1=S)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2504 |
| logD: | 3.2504 |
| logSw: | -3.3583 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 59.752 |
| InChI Key: | WDJGCBSKIGCWRB-MRXNPFEDSA-N |