dimethyl 5-{2-[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]acetamido}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{2-[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]acetamido}benzene-1,3-dicarboxylate
dimethyl 5-{2-[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]acetamido}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D262-1054 |
| Compound Name: | dimethyl 5-{2-[4-(4-methylphenyl)-1-oxo-5,6,7,8-tetrahydrophthalazin-2(1H)-yl]acetamido}benzene-1,3-dicarboxylate |
| Molecular Weight: | 489.53 |
| Molecular Formula: | C27 H27 N3 O6 |
| Smiles: | Cc1ccc(cc1)C1C2CCCCC=2C(N(CC(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1543 |
| logD: | 5.1543 |
| logSw: | -5.0048 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.884 |
| InChI Key: | LKWQZRFOIQFTBI-UHFFFAOYSA-N |