dimethyl 5-[2-(3-oxothiomorpholin-2-yl)acetamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[2-(3-oxothiomorpholin-2-yl)acetamido]benzene-1,3-dicarboxylate
dimethyl 5-[2-(3-oxothiomorpholin-2-yl)acetamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y020-7349 |
| Compound Name: | dimethyl 5-[2-(3-oxothiomorpholin-2-yl)acetamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 366.39 |
| Molecular Formula: | C16 H18 N2 O6 S |
| Smiles: | COC(c1cc(cc(c1)NC(CC1C(NCCS1)=O)=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3912 |
| logD: | 1.3911 |
| logSw: | -2.1279 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.736 |
| InChI Key: | GCOAAXLTMDHJTJ-LBPRGKRZSA-N |