4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 3128-9250 |
| Compound Name: | 4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 279.33 |
| Molecular Formula: | C12 H9 N O3 S2 |
| Smiles: | CC(=O)Oc1ccc(/C=C2/C(NC(=S)S2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.1462 |
| logD: | -0.205 |
| logSw: | -2.032 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.651 |
| InChI Key: | HKHCIEHUYXZTHL-UHFFFAOYSA-N |