Dimethyl-F-OICR-9429-COOH

• CAT Number: I045240
• CAS Number: 2407458-49-3
• Molecular Formula: C27H26F4N4O4
• Molecular Weight: 546.51
• Purity: ≥95%
• Synonyms: 4-fluoro-3-[3-[[6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]-4-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]phenyl]benzoic acid
• IUPAC Name: 4-fluoro-3-[3-[[6-oxo-4-(trifluoromethyl)-1H-pyridine-3-carbonyl]amino]-4-[(3R,5S)-3,4,5-trimethylpiperazin-1-yl]phenyl]benzoic acid
• InChI: InChI=1S/C27H26F4N4O4/c1-14-12-35(13-15(2)34(14)3)23-7-5-16(18-8-17(26(38)39)4-6-21(18)28)9-22(23)33-25(37)19-11-32-24(36)10-20(19)27(29,30)31/h4-11,14-15H,12-13H2,1-3H3,(H,32,36)(H,33,37)(H,38,39)/t14-,15+
• InChIKey: NLHFYALGJZKULH-GASCZTMLSA-N
• SMILES: C[C@@H]1CN(C[C@@H](N1C)C)C2=C(C=C(C=C2)C3=C(C=CC(=C3)C(=O)O)F)NC(=O)C4=CNC(=O)C=C4C(F)(F)F

Dimethyl-F-OICR-9429-COOH（Cat No.:I045240）is a functionalized derivative of the small-molecule inhibitor OICR-9429, designed to target the interaction between WD repeat domain 5 (WDR5) and mixed lineage leukemia (MLL) protein complexes. By incorporating a dimethyl group and a carboxylic acid functionality, this analog enables conjugation or probe development while retaining high binding affinity for WDR5. It is valuable for studying epigenetic regulation, particularly histone methylation and gene transcription processes. Dimethyl-F-OICR-9429-COOH serves as a versatile tool in chemical biology for target validation, drug discovery, and the design of WDR5-directed therapeutic strategies in cancer research.