SML1430

Bis-Imidazole phenol IDH1 inhibitor

≥98% (HPLC), solubility: 30 mg/mL in DMSOclear

• Synonym(s): 2,6-Bis((1H-Imidazol-1-yl)methyl)-4-(2,4,4-trimethylpentan-2-yl)phenol
• Empirical Formula (Hill Notation): C₂₂H₃₀N₄O
• CAS Number: 1648909-73-2
• Molecular Weight: 366.50
• PubChem Substance ID: 329825871
• NACRES: NA.77

Properties

• Quality Level: 100
• Assay: ≥98% (HPLC)
• form: powder
• color: white to beige
• solubility: DMSO: 30 mg/mL, clear
• storage temp.: 2-8°C
• SMILES string: OC1=C(CN2C=CN=C2)C=C(C(C)(CC(C)(C)C)C)C=C1CN3C=NC=C3
• InChI: 1S/C22H30N4O/c1-21(2,3)14-22(4,5)19-10-17(12-25-8-6-23-15-25)20(27)18(11-19)13-26-9-7-24-16-26/h6-11,15-16,27H,12-14H2,1-5H3
• InChI key: PCIJWPBOCDNTJF-UHFFFAOYSA-N

Description

Biochem/physiol Actions

Bis-imidazole phenol blocks D-2-hydroxyglutaric acid synthesis in cells.

bis-Imidazole phenol is a potent and cell permeable inhibitor of isocitrate dehydrogenase 1 (IDH1) mutant R132H that inhibits D-2-hydroxyglutaric acid (2HG) production in cells. bis-Imidazole phenol binds to an IDH1 R132H allosteric site at the dimer interface containing residue involved in binding of the catalytically essential divalent cation.

Safety Information

• Storage Class Code: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable