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Alternative_name
N-[2-(cyclohexylamino)-1-(2-methylphenyl)-2-oxoethyl]-N-(3-fluorophenyl)-2-methyl-1H-imidazole-1-acetamide; IDH-C35
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Description
A potent, selective inhibitor of mutant IDH1 (isocitrate dehydrogenase 1). AGI-5198 inhibits IDH1 R132H and R132C mutants in vitro with IC₅₀ values of 0.07 and 0.16 µM, respectively, but not wild-type IDH1, wild-type IDH2, or IDH2 mutants (IC₅₀ s > 100 μM). Under conditions of near complete 2-HG (2-hydroxyglutarate) inhibition, AGI-5198 can induce demethylation of histone H3K9me3 and expression
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CAS Number
1355326-35-0
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Structure Available
Yes
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Salt Form
No
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Molecular Formula
C₂₇H₃₁FN₄O₂
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Molecular Weight
462.56
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Cell Permeable
Yes
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Purity
≥98% by HPLC
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Solubilities
DMSO (~25 mg/ml) or Ethanol (~ 15 mg/ml)
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Handling
Protect from light and moisture
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Tag Line
A potent, selective inhibitor of mutant IDH1 (isocitrate dehydrogenase 1)
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Storage Condition
-20 ̊C
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Shipping Condition
gel pack
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Shelf Life
36 months
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PubChem CID
56645356
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SMILES
CC1=CC=CC=C1C(C(=O)NC2CCCCC2)N(C3=CC(=CC=C3)F)C(=O)CN4C=CN=C4C
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InChi
InChI=1S/C27H31FN4O2/c1-19-9-6-7-14-24(19)26(27(34)30-22-11-4-3-5-12-22)32(23-13-8-10-21(28)17-23)25(33)18-31-16-15-29-20(31)2/h6-10,13-17,22,26H,3-5,11-12,18H2,1-2H3,(H,30,34)
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InChi Key
FNYGWXSATBUBER-UHFFFAOYSA-N
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MSDS Available
Yes