dimethyl 5-[4-(2,4-dichlorophenoxy)butanamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[4-(2,4-dichlorophenoxy)butanamido]benzene-1,3-dicarboxylate
dimethyl 5-[4-(2,4-dichlorophenoxy)butanamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y031-8258 |
| Compound Name: | dimethyl 5-[4-(2,4-dichlorophenoxy)butanamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 440.28 |
| Molecular Formula: | C20 H19 Cl2 N O6 |
| Smiles: | COC(c1cc(cc(c1)NC(CCCOc1ccc(cc1[Cl])[Cl])=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7245 |
| logD: | 4.7245 |
| logSw: | -4.7599 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.968 |
| InChI Key: | MAFDMAFKFQZVDD-UHFFFAOYSA-N |