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Chemical Reagents>Heterocyclic Building Blocks> 4-(4-fluoro-3-(piperazine-1-carbonyl)benzyl)phthalazin-1(2H)-one
For research use only. Not for therapeutic Use.
4-(4-Fluoro-3-(piperazine-1-carbonyl)benzyl)phthalazin-1(2H)-one(CAT: L011774) is a complex heterocyclic compound featuring a phthalazinone core linked to a fluorinated benzyl group with a piperazine-1-carbonyl substituent. This structure is characteristic of kinase-targeting scaffolds and serves as a valuable intermediate in oncology drug discovery, particularly in the development of VEGFR, PDGFR, or PARP inhibitors. The combination of pharmacophoric motifs—including the piperazine ring and fluorinated aromatic moiety—enhances receptor binding affinity, solubility, and metabolic stability. It is commonly used in medicinal chemistry programs for structure–activity relationship (SAR) studies and the synthesis of novel small-molecule inhibitors with therapeutic potential in cancer and inflammatory diseases.
CAS Number | 763111-47-3 |
Molecular Formula | C20H19FN4O2 |
Purity | ≥95% |
Target | Cell Cycle/DNA Damage |
IUPAC Name | 4-[[4-fluoro-3-(piperazine-1-carbonyl)phenyl]methyl]-2H-phthalazin-1-one |
InChI | InChI=1S/C20H19FN4O2/c21-17-6-5-13(11-16(17)20(27)25-9-7-22-8-10-25)12-18-14-3-1-2-4-15(14)19(26)24-23-18/h1-6,11,22H,7-10,12H2,(H,24,26) |
InChIKey | MFFUYEOGICAKCK-UHFFFAOYSA-N |
SMILES | C1CN(CCN1)C(=O)C2=C(C=CC(=C2)CC3=NNC(=O)C4=CC=CC=C43)F |
Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |