dimethyl 5-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
dimethyl 5-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y020-5864 |
| Compound Name: | dimethyl 5-{3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C20 H19 N3 O6 S |
| Smiles: | Cc1cc(C)nc(n1)SC1CC(N(C1=O)c1cc(cc(c1)C(=O)OC)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0638 |
| logD: | 2.0628 |
| logSw: | -2.2901 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 88.411 |
| InChI Key: | NSDABNPTMOJLCA-HNNXBMFYSA-N |