dimethyl 5-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzene-1,3-dicarboxylate
dimethyl 5-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | D262-0938 |
| Compound Name: | dimethyl 5-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)acetamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 475.5 |
| Molecular Formula: | C26 H25 N3 O6 |
| Smiles: | COC(c1cc(cc(c1)NC(CN1C(C2CCCCC=2C(c2ccccc2)=N1)=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6258 |
| logD: | 4.6258 |
| logSw: | -4.4025 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.884 |
| InChI Key: | QAQBZMBWFVUDHV-UHFFFAOYSA-N |