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Chemical structure of CH 223191

GC16220

CH 223191

Also known as 2-methyl-N-[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]pyrazole-3-carboxamide

CH 223191 is an effective and specific antagonist of the aryl hydrocarbon receptor (AhR), capable of inhibiting TCDD-mediated AhR nuclear translocation and DNA binding, and suppresses TCDD-induced luciferase activity, with an IC50 of 0·03 μM

ChemicalCAS301326-22-7MW333.39FormulaC19H19N5O
CAS number
301326-22-7
Molecular weight
333.39
Formula
C19H19N5O
Solubility
≥ 33·3mg/mL in DMSO
InChIKey
LKTNEXPODAWWFM-UHFFFAOYSA-N
Catalogue number
GC16220
Brand
GLPBIO
Computed properties PubChem CID 3091786 · XLogP 3.9 · TPSA 71.6 Ų · H-bond donors 1
XLogP
3.9
TPSA
71.6 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
25

SMILES CC1=CC=CC=C1N=NC2=CC(=C(C=C2)NC(=O)C3=CC=NN3C)C

Computed descriptors from PubChem (CID 3091786), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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