AHR antagonist 2

For research use only. Not for therapeutic Use.

  • CAT Number: I016820
  • CAS Number: 2338747-54-7
  • Molecular Formula: C20H17F3N4O3
  • Molecular Weight: 418.37
  • Purity: ≥95%
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AHR Antagonist 2(CAT: I016820) is a highly potent small-molecule inhibitor of the aryl hydrocarbon receptor (AHR), a ligand-activated transcription factor involved in xenobiotic metabolism, immunity, and cancer progression. Extracted from patent WO2019101641A1 (compound example 1), this antagonist exhibits nanomolar potency with IC₅₀ values of 0.885 nM for human AHR and 2.03 nM for mouse AHR. By selectively blocking AHR activation, AHR Antagonist 2 serves as a valuable probe for studying AHR-mediated signaling pathways, immune regulation, and environmental toxin responses. It also holds promise in therapeutic research targeting autoimmunity, cancer immunology, and metabolic disease.


CAS Number 2338747-54-7
Synonyms

N-[(2S)-1-hydroxypropan-2-yl]-2-pyridin-3-yl-6-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carboxamide

Molecular Formula C20H17F3N4O3
Purity ≥95%
IUPAC Name N-[(2S)-1-hydroxypropan-2-yl]-2-pyridin-3-yl-6-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carboxamide
InChI InChI=1S/C20H17F3N4O3/c1-12(11-28)25-19(29)17-9-16(26-18(27-17)14-3-2-8-24-10-14)13-4-6-15(7-5-13)30-20(21,22)23/h2-10,12,28H,11H2,1H3,(H,25,29)/t12-/m0/s1
InChIKey CSSGBPKFVJOAIZ-LBPRGKRZSA-N
SMILES CC(CO)NC(=O)C1=NC(=NC(=C1)C2=CC=C(C=C2)OC(F)(F)F)C3=CN=CC=C3
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