4-[(4-{[1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
Chemical Structure Depiction of
4-[(4-{[1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
4-[(4-{[1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid
Compound characteristics
| Compound ID: | 4098-1404 |
| Compound Name: | 4-[(4-{[1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)methyl]benzoic acid |
| Molecular Weight: | 460.51 |
| Molecular Formula: | C25 H20 N2 O5 S |
| Smiles: | COc1ccc(cc1)N1C(/C(=C/c2ccc(cc2)OCc2ccc(cc2)C(O)=O)NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5103 |
| logD: | 1.5388 |
| logSw: | -4.4243 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.076 |
| InChI Key: | DEKKZDJSWAVJPX-UHFFFAOYSA-N |