2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzoate
Chemical Structure Depiction of
2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzoate
2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzoate
Compound characteristics
| Compound ID: | 3559-3605 |
| Compound Name: | 2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenyl benzoate |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C18 H13 N O4 S2 |
| Smiles: | COc1cc(/C=C2/C(NC(=S)S2)=O)ccc1OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6228 |
| logD: | 1.2716 |
| logSw: | -3.2162 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.995 |
| InChI Key: | JMBPSSAWTNWCCW-UHFFFAOYSA-N |