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RAF 265

CAT: 0572-TRC-R072900-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-R072900-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
927880-90-8
Synonyms
RAF 265
Hazard Statement
No Data Available
Smiles
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc3cc(Oc4ccnc(c4)c5ncc([nH]5)C(F)(F)F)ccc13
Molecular Formula
C24 H16 F6 N6 O
Molecular Weight
518.414
InChI
InChI=1S/C24H16F6N6O/c1-36-19-7-6-15(10-17(19)34-22(36)33-14-4-2-13(3-5-14)23(25,26)27)37-16-8-9-31-18(11-16)21-32-12-20(35-21)24(28,29)30/h2-12H,1H3,(H,32,35)(H,33,34)
Additionnal Information
IUPAC name: 1-methyl-5-[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyridin-4-yl]oxy-N-[4-(trifluoromethyl)phenyl]benzimidazol-2-amine
Shipping Conditions
Room Temperature

Chemical Information

Raf265

CHIR-265 is a member of the class of benzimidazoles that is 1H-benzimidazole substituted by methyl, [4-(trifluoromethyl)phenyl]amino, and {2-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyridin-4-yl}oxy groups at positions 1, 2, and 5, respectively. It is an inhibitor of RAF kinases, including the BRAF V600E mutant. It has a role as an antiviral agent, an antineoplastic agent, an angiogenesis inhibitor, an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor, an apoptosis inducer and a B-Raf inhibitor. It is a member of benzimidazoles, a member of imidazoles, a member of pyridines, an aromatic ether, an organofluorine compound, a substituted aniline and a member of (trifluoromethyl)benzenes.

CAS Number927880-90-8
PubChem CID11656518
IUPAC Name1-methyl-5-[[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]-4-pyridinyl]oxy]-N-[4-(trifluoromethyl)phenyl]benzimidazol-2-amine
Molecular FormulaC24H16F6N6O
Molecular Weight518.4
XLogP5.4
Topological Polar Surface Area80.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Heavy Atom Count37
Formal Charge0
Complexity763
SMILES
CN1C2=C(C=C(C=C2)OC3=CC(=NC=C3)C4=NC=C(N4)C(F)(F)F)N=C1NC5=CC=C(C=C5)C(F)(F)F
InChI
InChI=1S/C24H16F6N6O/c1-36-19-7-6-15(10-17(19)34-22(36)33-14-4-2-13(3-5-14)23(25,26)27)37-16-8-9-31-18(11-16)21-32-12-20(35-21)24(28,29)30/h2-12H,1H3,(H,32,35)(H,33,34)
InChIKey
YABJJWZLRMPFSI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Raf265
CAS: 927880-90-8
CID: 11656518
Formula: C24H16F6N6O
MW: 518.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight518.4
XLogP35.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count5
Exact Mass518.12897813
Monoisotopic Mass518.12897813
Topological Polar Surface Area80.7 Ų
Heavy Atom Count37
Formal Charge0
Complexity763
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

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