| Identification | Back Directory | [Name]
KI696 isomer | [CAS]
1799974-69-8 | [Synonyms]
KI696 isomer
1H-Benzotriazole-5-propanoic acid, β-[3-[[(4R)-3,4-dihydro-4-methyl-1,1-dioxido-2H-5,1,2-benzoxathiazepin-2-yl]methyl]-4-methylphenyl]-7-methoxy-1-methyl-, (βR)- | [Molecular Formula]
C28H30N4O6S | [MOL File]
1799974-69-8.mol | [Molecular Weight]
550.63 |
| Chemical Properties | Back Directory | [Boiling point ]
760.5±70.0 °C(Predicted) | [density ]
1.39±0.1 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMSO : 125 mg/mL (227.01 mM);Water : < 0.1 mg/mL (insoluble) | [form ]
Solid | [pka]
4.28±0.10(Predicted) | [color ]
White to off-white |
| Hazard Information | Back Directory | [Description]
KI696 isomer is the less active isomer of KI696. KI696 is a high affinity probe that disrupts the Keap1/NRF2 interaction.
| [storage]
Store at -20°C | [References]
[1]. Davies TG, et al. Monoacidic Inhibitors of the Kelch-like ECH-Associated Protein 1: Nuclear Factor Erythroid 2-Related Factor 2 (KEAP1:NRF2) Protein-Protein Interaction with High Cell Potency Identified by Fragment-Based Discovery. J Med Chem. 2016 Apr 28;59(8):3991-4006. |
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