methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)butanamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)butanamido]benzoate
methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)butanamido]benzoate
Compound characteristics
| Compound ID: | D262-0763 |
| Compound Name: | methyl 4-[2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2(1H)-yl)butanamido]benzoate |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C26 H27 N3 O4 |
| Smiles: | CCC(C(Nc1ccc(cc1)C(=O)OC)=O)N1C(C2CCCCC=2C(c2ccccc2)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1729 |
| logD: | 5.1728 |
| logSw: | -5.0602 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.042 |
| InChI Key: | ZMITUWBNDKOXHZ-QFIPXVFZSA-N |