ethyl 4-{3-[(5-ethyl-4,6-dihydroxypyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-[(5-ethyl-4,6-dihydroxypyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
ethyl 4-{3-[(5-ethyl-4,6-dihydroxypyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | Y020-7214 |
| Compound Name: | ethyl 4-{3-[(5-ethyl-4,6-dihydroxypyrimidin-2-yl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate |
| Molecular Weight: | 417.44 |
| Molecular Formula: | C19 H19 N3 O6 S |
| Smiles: | CCc1c(nc(nc1O)SC1CC(N(C1=O)c1ccc(cc1)C(=O)OCC)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0023 |
| logD: | 1.9157 |
| logSw: | -2.6103 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.125 |
| InChI Key: | TUEOOKZAGFZVPN-ZDUSSCGKSA-N |