methyl 4-{[1-(4-ethoxyphenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[1-(4-ethoxyphenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}benzoate
methyl 4-{[1-(4-ethoxyphenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}benzoate
Compound characteristics
| Compound ID: | 5777-0613 |
| Compound Name: | methyl 4-{[1-(4-ethoxyphenyl)-3-methyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl}benzoate |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C21 H20 N2 O4 S |
| Smiles: | CCOc1ccc(cc1)N1C(/C(=C/c2ccc(cc2)C(=O)OC)N(C)C1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5461 |
| logD: | 3.5461 |
| logSw: | -3.6216 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.599 |
| InChI Key: | IYUQSNGNQHVPPG-UHFFFAOYSA-N |