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2869954-34-5

2869954-34-5 Structure

2869954-34-5 Structure
IdentificationBack Directory
[Name]

[1,2,4]Triazolo[1,5-a]pyrimidine-4(7H)-acetamide, N-[2-chloro-4-(trifluoromethyl)phenyl]-2-(3,6-dihydro-2H-pyran-4-yl)-5-ethyl-6-[4-[(5-hydroxy-6-methyl-4-pyrimidinyl)carbonyl]-1-piperazinyl]-7-oxo-
[CAS]

2869954-34-5
[Synonyms]

Werner syndrome RecQ helicase-IN-1
N-(2-chloro-4-(trifluoromethyl)phenyl)-2-(2-(3,6-dihydro-2H-pyran-4-yl)-5-ethyl-6-(4-(5-hydroxy-6-methylpyrimidine-4-carbonyl)piperazin-1-yl)-7-oxo-[1,2,4]triazolo[1,5-a]pyrimidin-4(7H)-yl)acetamide
[1,2,4]Triazolo[1,5-a]pyrimidine-4(7H)-acetamide, N-[2-chloro-4-(trifluoromethyl)phenyl]-2-(3,6-dihydro-2H-pyran-4-yl)-5-ethyl-6-[4-[(5-hydroxy-6-methyl-4-pyrimidinyl)carbonyl]-1-piperazinyl]-7-oxo-
[Molecular Formula]

C31H31ClF3N9O5
[MOL File]

2869954-34-5.mol
[Molecular Weight]

702.08
Chemical PropertiesBack Directory
[density ]

1.58±0.1 g/cm3(Predicted)
[solubility ]

DMSO: Slightly soluble: 0.1-1 mg/ml
[form ]

Solid
[pka]

5.87±0.45(Predicted)
[color ]

White to light yellow
[InChIKey]

XKYVECRUZPCRQR-UHFFFAOYSA-N
[SMILES]

C12=NC(C3=CCOCC3)=NN1C(=O)C(N1CCN(C(C3C(O)=C(C)N=CN=3)=O)CC1)=C(CC)N2CC(NC1=CC=C(C(F)(F)F)C=C1Cl)=O
Hazard InformationBack Directory
[Uses]

HRO761 (Werner syndrome RecQ helicase-IN-1) (example 42) is a potent Werner syndrome RecQ DNA helicase enzyme (WRN) inhibitor and can be used in cancer research[1].
[References]

[1] Triazolo-pyrimidine analogues for treating diseases connected to the inhibiton of werner syndrome recq helicase (wrn). WO2022249060
Spectrum DetailBack Directory
[Spectrum Detail]

[1,2,4]Triazolo[1,5-a]pyrimidine-4(7H)-acetamide, N-[2-chloro-4-(trifluoromethyl)phenyl]-2-(3,6-dihydro-2H-pyran-4-yl)-5-ethyl-6-[4-[(5-hydroxy-6-methyl-4-pyrimidinyl)carbonyl]-1-piperazinyl]-7-oxo-(2869954-34-5)1HNMR
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