dimethyl 5-{3-[(4,6-dihydroxy-5-methylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{3-[(4,6-dihydroxy-5-methylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
dimethyl 5-{3-[(4,6-dihydroxy-5-methylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y020-7212 |
| Compound Name: | dimethyl 5-{3-[(4,6-dihydroxy-5-methylpyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzene-1,3-dicarboxylate |
| Molecular Weight: | 447.42 |
| Molecular Formula: | C19 H17 N3 O8 S |
| Smiles: | Cc1c(nc(nc1O)SC1CC(N(C1=O)c1cc(cc(c1)C(=O)OC)C(=O)OC)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1469 |
| logD: | 1.0714 |
| logSw: | -1.7787 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 122.719 |
| InChI Key: | NUUYRCIAFLIRHB-LBPRGKRZSA-N |