{4-bromo-2-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Chemical Structure Depiction of
{4-bromo-2-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
{4-bromo-2-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy}acetic acid
Compound characteristics
| Compound ID: | 5790-2367 |
| Compound Name: | {4-bromo-2-[(5-oxo-1-propyl-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy}acetic acid |
| Molecular Weight: | 399.26 |
| Molecular Formula: | C15 H15 Br N2 O4 S |
| Smiles: | CCCN1C(/C(=C/c2cc(ccc2OCC(O)=O)[Br])NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3324 |
| logD: | -0.9045 |
| logSw: | -3.4912 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.728 |
| InChI Key: | OHVXGFMIVDGXMU-UHFFFAOYSA-N |