dimethyl 5-{2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzene-1,3-dicarboxylate
dimethyl 5-{2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D279-0127 |
| Compound Name: | dimethyl 5-{2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzene-1,3-dicarboxylate |
| Molecular Weight: | 449.46 |
| Molecular Formula: | C24 H23 N3 O6 |
| Smiles: | Cc1ccc(cc1C)C1C=CC(N(CC(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4441 |
| logD: | 4.4441 |
| logSw: | -4.3538 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.045 |
| InChI Key: | BBYAQXCWNYOYRN-UHFFFAOYSA-N |