{2-methoxy-4-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}acetic acid
Chemical Structure Depiction of
{2-methoxy-4-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}acetic acid
{2-methoxy-4-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 4245-0454 |
| Compound Name: | {2-methoxy-4-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]phenoxy}acetic acid |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C18 H14 O5 S |
| Smiles: | COc1cc(/C=C2/C(c3ccccc3S2)=O)ccc1OCC(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.925 |
| logD: | -1.312 |
| logSw: | -3.3834 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57 |
| InChI Key: | HZSKYUARSLCKST-UHFFFAOYSA-N |