8-Chloro-2-phenyl-3-((1S)-1-((9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-yl)amino)ethyl)isoquinolin-1(2H)-one

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Analyte Name

8-Chloro-2-phenyl-3-((1S)-1-((9-(tetrahydro-2H-pyran-2-yl)-9H-purin-6-yl)amino)ethyl)isoquinolin-1(2H)-one

CAS Number

1350643-73-0

Molecular Formula

C27 H25 Cl N6 O2

Molecular Weight

500.979

Accurate Mass

500.173

SMILES

C[C@H](Nc1ncnc2c1ncn2C3CCCCO3)C4=Cc5cccc(Cl)c5C(=O)N4c6ccccc6

InChI

InChI=1S/C27H25ClN6O2/c1-17(32-25-24-26(30-15-29-25)33(16-31-24)22-12-5-6-13-36-22)21-14-18-8-7-11-20(28)23(18)27(35)34(21)19-9-3-2-4-10-19/h2-4,7-11,14-17,22H,5-6,12-13H2,1H3,(H,29,30,32)/t17-,22?/m0/s1

IUPAC

8-chloro-3-[(1S)-1-[[9-(oxan-2-yl)purin-6-yl]amino]ethyl]-2-phenylisoquinolin-1-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat