{2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid
Chemical Structure Depiction of
{2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid
{2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 4299-0303 |
| Compound Name: | {2-methoxy-4-[(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy}acetic acid |
| Molecular Weight: | 325.36 |
| Molecular Formula: | C13 H11 N O5 S2 |
| Smiles: | COc1cc(/C=C2/C(NC(=S)S2)=O)ccc1OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6818 |
| logD: | -3.5551 |
| logSw: | -2.0744 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.5 |
| InChI Key: | DVBJNSKWHSGTDK-UHFFFAOYSA-N |