4-[(2-{[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
Chemical Structure Depiction of
4-[(2-{[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
4-[(2-{[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
Compound characteristics
| Compound ID: | 5371-3706 |
| Compound Name: | 4-[(2-{[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C26 H22 N2 O5 S |
| Smiles: | CCOc1ccc(cc1)N1C(/C(=C/c2ccccc2OCc2ccc(cc2)C(O)=O)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.272 |
| logD: | 2.3005 |
| logSw: | -5.119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.743 |
| InChI Key: | FHXGQLKYGFXACI-UHFFFAOYSA-N |