dimethyl 5-[2-(azepan-1-yl)acetamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[2-(azepan-1-yl)acetamido]benzene-1,3-dicarboxylate
dimethyl 5-[2-(azepan-1-yl)acetamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y206-5886 |
| Compound Name: | dimethyl 5-[2-(azepan-1-yl)acetamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C18 H24 N2 O5 |
| Smiles: | COC(c1cc(cc(c1)NC(CN1CCCCCC1)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6853 |
| logD: | 3.6425 |
| logSw: | -3.805 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.799 |
| InChI Key: | ONSZWGNCCNUZFK-UHFFFAOYSA-N |