ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-chloroanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-chloroanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-chloroanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | C148-0045 |
| Compound Name: | ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-chloroanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate |
| Molecular Weight: | 517 |
| Molecular Formula: | C24 H25 Cl N4 O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C(CC(Nc2ccc(cc2)[Cl])=O)N(CCNC(C)=O)C1=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3078 |
| logD: | 2.3074 |
| logSw: | -3.4293 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.826 |
| InChI Key: | UXWOJCHCFGHHDO-FQEVSTJZSA-N |