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Chemical structure of GNE-9815

GC65949

GNE-9815

Also known as 3-(2-cyanopropan-2-yl)-N-[2-fluoro-4-methyl-5-(7-methyl-8-oxopyrido[2,3-d]pyridazin-3-yl)phenyl]benzamide

GNE-9815 (compound 7) is a highly selective, pan-RAF inhibitor with good oral bioavailability· GNE-9815 exhibits Ki values of 0·062 and 0·19 nM for CRAF and BRAF, respectively· GNE-9815 combines with MEK inhibitor Cobimetinib (HY-13064) shows synergistic modulation of MAPK pathway· GNE-9815 can be used in studies of KRAS mutant cancers

ChemicalCAS2729996-45-4MW455.48FormulaC26H22FN5O2
CAS number
2729996-45-4
Molecular weight
455.48
Formula
C26H22FN5O2
Solubility
DMSO ： 50 mg/mL (109·77 mM; ultrasonic and warming and heat to 80°C)
InChIKey
SXCTZLXYGLXXRY-UHFFFAOYSA-N
Catalogue number
GC65949
Brand
GLPBIO
Computed properties PubChem CID 155920128 · XLogP 3.7 · TPSA 98.5 Ų · H-bond donors 1
XLogP
3.7
TPSA
98.5 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
34

SMILES CC1=CC(=C(C=C1C2=CN=C3C(=C2)C=NN(C3=O)C)NC(=O)C4=CC(=CC=C4)C(C)(C)C#N)F

Computed descriptors from PubChem (CID 155920128), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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