| Identification | Back Directory | [Name]
N-(2-(1H-indol-3-yl)ethyl)-9-isopropyl-2-(5-Methylpyridin-3-yl)-9H-purin-6-aMine | [CAS]
1227634-69-6 | [Synonyms]
N-(2-(1H-indol-3-yl)ethyl)-9-isopropyl-2-(5-Methylpyridin-3-yl)-9H-purin-6-aMine
9H-Purin-6-amine, N-[2-(1H-indol-3-yl)ethyl]-9-(1-methylethyl)-2-(5-methyl-3-pyridinyl)- | [Molecular Formula]
C24H25N7 | [MDL Number]
MFCD23726597 | [MOL File]
1227634-69-6.mol | [Molecular Weight]
411.5 |
| Chemical Properties | Back Directory | [Boiling point ]
606.8±65.0 °C(Predicted) | [density ]
1.31±0.1 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMSO : ≥ 125 mg/mL (303.77 mM);Water : < 0.1 mg/mL (insoluble) | [form ]
Solid | [pka]
17.15±0.30(Predicted) | [color ]
Off-white to light yellow | [InChI]
1S/C24H25N7/c1-15(2)31-14-28-21-23(26-9-8-17-13-27-20-7-5-4-6-19(17)20)29-22(30-24(21)31)18-10-16(3)11-25-12-18/h4-7,10-15,27H,8-9H2,1-3H3,(H,26,29,30) | [InChIKey]
ABXIUYMKZDZUDC-UHFFFAOYSA-N | [SMILES]
[n]1(c2nc(nc(c2nc1)NCCc4c5c([nH]c4)cccc5)c3cncc(c3)C)C(C)C |
| Hazard Information | Back Directory | [Uses]
A cell-permeable purine compound that acts as a high-affinity aryl hydrocarbon receptor (AhR) antagonist (IC50 = 62 nM in mouse liver cytosol expressing humanized AhR) and lacks any agonist activity even at higher doses. Reportedly binds with high affinity to the ligand-binding pocket of AhR and blocks the binding of an array of exogenous and endogenous ligands. Shown to non-covalently interact with Ser317, His291, and Ser365 in human and with Ser311, His285, and Ser359 in mouse AhR. Represses AhR transcriptional activity via the dioxin response element (DRE)-dependent and independent mediated responses in human and mouse cells (IC50 = 8.5 nM in HepG2 40/6 cells). | [storage]
Store at -20°C |
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InvivoChem
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https://www.invivochem.cn/ |
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