dimethyl 2-(4-chloro-3-nitrobenzamido)benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-(4-chloro-3-nitrobenzamido)benzene-1,4-dicarboxylate
dimethyl 2-(4-chloro-3-nitrobenzamido)benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | Y031-8277 |
| Compound Name: | dimethyl 2-(4-chloro-3-nitrobenzamido)benzene-1,4-dicarboxylate |
| Molecular Weight: | 392.75 |
| Molecular Formula: | C17 H13 Cl N2 O7 |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.249 |
| logD: | 0.5013 |
| logSw: | -3.8882 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.06 |
| InChI Key: | NEARBDRQBFDZSR-UHFFFAOYSA-N |