dimethyl 2-[2-(4-methylbenzene-1-sulfonyl)acetamido]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[2-(4-methylbenzene-1-sulfonyl)acetamido]benzene-1,4-dicarboxylate
dimethyl 2-[2-(4-methylbenzene-1-sulfonyl)acetamido]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | Y032-4023 |
| Compound Name: | dimethyl 2-[2-(4-methylbenzene-1-sulfonyl)acetamido]benzene-1,4-dicarboxylate |
| Molecular Weight: | 405.42 |
| Molecular Formula: | C19 H19 N O7 S |
| Smiles: | Cc1ccc(cc1)S(CC(Nc1cc(ccc1C(=O)OC)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.441 |
| logD: | 2.3184 |
| logSw: | -2.9235 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.802 |
| InChI Key: | LLKWSCFGQKEENE-UHFFFAOYSA-N |