dimethyl 5-(3-methyl-4-nitrobenzamido)benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-(3-methyl-4-nitrobenzamido)benzene-1,3-dicarboxylate
dimethyl 5-(3-methyl-4-nitrobenzamido)benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y031-9776 |
| Compound Name: | dimethyl 5-(3-methyl-4-nitrobenzamido)benzene-1,3-dicarboxylate |
| Molecular Weight: | 372.33 |
| Molecular Formula: | C18 H16 N2 O7 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.928 |
| logD: | 3.9232 |
| logSw: | -4.2497 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.758 |
| InChI Key: | WIVUEIFIRULVQH-UHFFFAOYSA-N |