methyl (2-{[1-(4-chlorophenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)acetate
Chemical Structure Depiction of
methyl (2-{[1-(4-chlorophenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)acetate
methyl (2-{[1-(4-chlorophenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)acetate
Compound characteristics
| Compound ID: | 5777-0627 |
| Compound Name: | methyl (2-{[1-(4-chlorophenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}phenoxy)acetate |
| Molecular Weight: | 416.88 |
| Molecular Formula: | C20 H17 Cl N2 O4 S |
| Smiles: | CN1C(=C/c2ccccc2OCC(=O)OC)\C(N(C1=S)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.302 |
| logD: | 3.302 |
| logSw: | -3.6871 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.466 |
| InChI Key: | XFYCYJHAVKHZFE-UHFFFAOYSA-N |