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CCT196969

CAT: 0013-GTR19169097-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19169097-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CCT196969
CAS Number
1163719-56-9
Product Name Alternative
Inhibit, Inhibitor, CCT196969, CCT-196969, CCT 196969, C-RAF, Src, Raf, Raf kinases
Field of Research
Cardiovascular Research, Signal Transduction
Purity
98.58% (May vary between batches)
Solubility
H2O:Insoluble; DMSO:127.5 mg/mL (248.29 mM) ; Ethanol:Insoluble;10% DMSO+40% PEG300+5% Tween 80+45% Saline:4 mg/mL (7.79 mM)
Smiles
CC (C) (C) c1cc (NC (=O) Nc2ccc (Oc3ccnc4[nH]c (=O) cnc34) cc2F) n (n1) -c1ccccc1
Molecular Formula
C27H24FN7O3
Molecular Weight
513.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cct196969
CAS Number1163719-56-9
PubChem CID42628843
IUPAC Name1-(3-tert-butyl-1-phenylpyrazol-5-yl)-3-[2-fluoro-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
Molecular FormulaC27H24FN7O3
Molecular Weight513.5
XLogP4.2
Topological Polar Surface Area123
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count38
Formal Charge0
Complexity877
SMILES
CC(C)(C)C1=NN(C(=C1)NC(=O)NC2=C(C=C(C=C2)OC3=C4C(=NC=C3)NC(=O)C=N4)F)C5=CC=CC=C5
InChI
InChI=1S/C27H24FN7O3/c1-27(2,3)21-14-22(35(34-21)16-7-5-4-6-8-16)32-26(37)31-19-10-9-17(13-18(19)28)38-20-11-12-29-25-24(20)30-15-23(36)33-25/h4-15H,1-3H3,(H,29,33,36)(H2,31,32,37)
InChIKey
KYYKGSDLXXKQCR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cct196969
CAS: 1163719-56-9
CID: 42628843
Formula: C27H24FN7O3
MW: 513.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight513.5
XLogP34.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass513.19246582
Monoisotopic Mass513.19246582
Topological Polar Surface Area123 Ų
Heavy Atom Count38
Formal Charge0
Complexity877
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA6529-25CCT196969
A22372-50CCT196969 50mg
A22372-5CCT196969 5mg
A22372-100CCT196969 100mg

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