methyl 4-(2-{3-[(4-chlorophenyl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{3-[(4-chlorophenyl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
methyl 4-(2-{3-[(4-chlorophenyl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | 2739-0338 |
| Compound Name: | methyl 4-(2-{3-[(4-chlorophenyl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C22 H22 Cl N3 O4 S |
| Smiles: | CCN1C(C(CC(Nc2ccc(cc2)C(=O)OC)=O)N(Cc2ccc(cc2)[Cl])C1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4071 |
| logD: | 3.4067 |
| logSw: | -3.9298 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.179 |
| InChI Key: | LKFXXEDYNVUVGC-SFHVURJKSA-N |