2-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
Chemical Structure Depiction of
2-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
2-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate
Compound characteristics
| Compound ID: | 3584-0234 |
| Compound Name: | 2-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzenesulfonate |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C16 H11 N O4 S3 |
| Smiles: | C(=C1/C(NC(=S)S1)=O)\c1ccccc1OS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4566 |
| logD: | 1.3903 |
| logSw: | -2.9221 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.748 |
| InChI Key: | TUGVKJVFOHWGLV-UHFFFAOYSA-N |