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2436544-27-1

2436544-27-1 Structure

2436544-27-1 Structure
IdentificationBack Directory
[Name]

Propanamide, 3-[[6-chloro-8-fluoro-7-(2-fluoro-6-hydroxyphenyl)-4-[4-(1-oxo-2-propen-1-yl)-1-piperazinyl]-2-quinazolinyl]amino]-N-methyl-N-2-propyn-1-yl-
[CAS]

2436544-27-1
[Synonyms]

ARS1323 Alkyne
Propanamide, 3-[[6-chloro-8-fluoro-7-(2-fluoro-6-hydroxyphenyl)-4-[4-(1-oxo-2-propen-1-yl)-1-piperazinyl]-2-quinazolinyl]amino]-N-methyl-N-2-propyn-1-yl-
[Molecular Formula]

C28H27ClF2N6O3
[MDL Number]

MFCD32067946
[MOL File]

2436544-27-1.mol
[Molecular Weight]

569
Chemical PropertiesBack Directory
[Boiling point ]

767.3±70.0 °C(Predicted)
[density ]

1.398±0.06 g/cm3(Predicted)
[storage temp. ]

4°C, stored under nitrogen
[solubility ]

DMSO : 35.71 mg/mL (62.76 mM; Need ultrasonic)
[form ]

Solid
[pka]

6.00±0.35(Predicted)
[color ]

Off-white to light brown
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard InformationBack Directory
[Uses]

ARS-1323-alkyne, a switch-II pocket (S-IIP) inhibitor, is a conformational specific chemical reporter of KRASG12C nucleotide state in living cells[1]. ARS-1323-alkyne is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
[IC 50]

KRAS(G12C)
[storage]

4°C, stored under nitrogen
[References]

[1] Lou K,et al. KRASG12C inhibition produces a driver-limited state revealing collateral dependencies. Sci Signal. 2019 May 28;12(583). pii: eaaw9450. DOI:10.1126/scisignal.aaw9450
Spectrum DetailBack Directory
[Spectrum Detail]

Propanamide, 3-[[6-chloro-8-fluoro-7-(2-fluoro-6-hydroxyphenyl)-4-[4-(1-oxo-2-propen-1-yl)-1-piperazinyl]-2-quinazolinyl]amino]-N-methyl-N-2-propyn-1-yl-(2436544-27-1)1HNMR
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