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Chemical structure of AHR agonist 3

GC77009

AHR agonist 3

Also known as 3,10-diazapentacyclo[10.7.1.02,10.04,9.016,20]icosa-1(19),2,4,6,8,12,14,16(20),17-nonaen-11-one

AHR agonist 3 is an aryl hydrocarbon receptor (AhR) agonist, that can induces cell cycle arrest or apoptosis via activation of tumor-suppressive transcriptional programs

ChemicalCAS23749-58-8MW270.28FormulaC18H10N2O
CAS number
23749-58-8
Molecular weight
270.28
Formula
C18H10N2O
Solubility
DMSO： 10 mg/mL (37·00 mM; ultrasonic and warming and heat to 60°C)
InChIKey
NZBSAAMEZYOGBA-UHFFFAOYSA-N
Catalogue number
GC77009
Brand
GLPBIO
Computed properties PubChem CID 90247 · XLogP 4 · TPSA 34.9 Ų · H-bond donors 0
XLogP
4
TPSA
34.9 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
21

SMILES C1=CC=C2C(=C1)N=C3N2C(=O)C4=CC=CC5=C4C3=CC=C5

Computed descriptors from PubChem (CID 90247), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
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