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ChemicalBook--->CAS DataBase List--->404009-40-1

404009-40-1

404009-40-1 Structure

404009-40-1 Structure
IdentificationBack Directory
[Name]

IC86621
[CAS]

404009-40-1
[Synonyms]

IC 86621 (IC86621)
IC86621 CAS#: 404009-40-1
1-(2-hydroxy-4-Morpholinophenyl)ethanone
1-(2-Hydroxy-4-morpholinophenyl)ethan-1-one
Ethanone, 1-[2-hydroxy-4-(4-morpholinyl)phenyl]-
DNA-PK Inhibitor III - CAS 404009-40-1 - Calbiochem
ATP,Buchwald-Hartwig amination,Inhibitor,IC-86621,IC86621,IC 86621,DSB,antitumor,inhibit,Apoptosis,Fries rearrangement,DNA-dependent protein kinase,DNA-PK
[Molecular Formula]

C12H15NO3
[MDL Number]

MFCD07370140
[MOL File]

404009-40-1.mol
[Molecular Weight]

221.25
Chemical PropertiesBack Directory
[Melting point ]

98-100.3 °C
[Boiling point ]

425.5±45.0 °C(Predicted)
[density ]

1.210±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO: 15 mg/mL
[form ]

solid
[pka]

10.47±0.10(Predicted)
[color ]

off-white
Safety DataBack Directory
[WGK Germany ]

3
Hazard InformationBack Directory
[Definition]

ChEBI: 1-[2-hydroxy-4-(4-morpholinyl)phenyl]ethanone is an aromatic ketone.
[General Description]

A cell-permeable aryl-morpholino compound that acts as a potent, selective, reversible, and ATP-competitive inhibitor of DNA-PK (IC50 = 120 nM) and PI 3-Kinase catalytic subunit p110β (IC50 = 135 nM). It inhibits DNA-PK-mediated cellular DNA DSB (double strand break) repair (EC50 = 68 μM) and enhances DSB-induced antitumor activity both in vitro and in vivo, while exhibiting no cytotoxic effects (up to 50 μM) in the absence of DSBs. It inhibits PI 3-K p110α, p110γ, and p110δ only at much higher concentrations (IC50 = 1.4, 0.88, and 1.0 μM, respectively) and exhibits no effect against a panel of several other kinases, including, Cdk2, Src, PKA, PKC, Chk1, CK1, ATM, and FKBP12, even at concentrations as high as 100 μM.
[Biochem/physiol Actions]

Cell permeable: yes
Spectrum DetailBack Directory
[Spectrum Detail]

IC86621(404009-40-1)1HNMR
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