ChemicalBook--->CAS DataBase List--->666837-93-0

666837-93-0

666837-93-0 Structure

666837-93-0 Structure
IdentificationBack Directory
[Name]

SU 9516
[CAS]

666837-93-0
[Synonyms]

SU 9516
3-((1H-Imidazol-5-yl)methylene)-5-methoxyindolin-2-one
(Z)-3-((1H-iMidazol-5-yl)Methylene)-5-Methoxyindolin-2-one
1,3-Dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-2H-indol-2-one
2H-Indol-2-one, 1,3-dihydro-3-(1H-imidazol-5-ylmethylene)-5-methoxy-
SU 9516;SU9516;(Z)-3-((1H-IMIDAZOL-5-YL)METHYLENE)-5-METHOXYINDOLIN-2-ONE
3-[1-(3H-IMIDAZOL-4-YL)-METH-(Z)-YLIDENE]-5-METHOXY-1,3-DIHYDRO-INDOL-2-ONE
[Molecular Formula]

C13H11N3O2
[MDL Number]

MFCD17010284
[MOL File]

666837-93-0.mol
[Molecular Weight]

241.25
Chemical PropertiesBack Directory
[Boiling point ]

601.5±55.0 °C(Predicted)
[density ]

1.383±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO: ~17 mg/mL
[form ]

crystalline
[pka]

11?+-.0.20(Predicted)
[color ]

brown
[InChI]

1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)
[InChIKey]

QNUKRWAIZMBVCU-UHFFFAOYSA-N
[SMILES]

[nH]1cncc1C=C2c3c(ccc(c3)OC)NC2=O
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Safety Statements ]

22-24/25
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

SU 9516 is a 3-substituted indolinone CDK inhibitor with potent and selective inhibition towards cyclin-dependant kinases.
[Uses]

SU9516 is a selectively potent ATP-competitive inhibitor of CDKs.
[Definition]

ChEBI: 3-(1H-imidazol-5-ylmethylidene)-5-methoxy-1H-indol-2-one is a member of indoles.
[Biological Activity]

Cell permeable: yes''Primary Target
Cdk2/A''Product competes with ATP.''Reversible: yes''Target IC50: 22 nM for Cdk2/A; 40 nM for Cdk1/B; 200 nM for Cdk4/D1
Spectrum DetailBack Directory
[Spectrum Detail]

SU 9516(666837-93-0)1HNMR
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