ethyl 4-{3-[(2-anilino-2-oxoethyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-[(2-anilino-2-oxoethyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
ethyl 4-{3-[(2-anilino-2-oxoethyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | 5512-0116 |
| Compound Name: | ethyl 4-{3-[(2-anilino-2-oxoethyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate |
| Molecular Weight: | 412.46 |
| Molecular Formula: | C21 H20 N2 O5 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(CC(C1=O)SCC(Nc1ccccc1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4856 |
| logD: | 2.4856 |
| logSw: | -2.8177 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.061 |
| InChI Key: | JQYMWPBSWICARG-KRWDZBQOSA-N |