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Chemical structure of Merestinib dihydrochloride

GC36585

Merestinib dihydrochloride

Also known as N-[3-fluoro-4-[1-methyl-6-(1H-pyrazol-4-yl)indazol-5-yl]oxyphenyl]-1-(4-fluorophenyl)-6-methyl-2-oxopyridine-3-carboxamide;dihydrochloride

Merestinib dihydrochloride (LY2801653 dihydrochloride) is a potent, orally bioavailable c-Met inhibitor (Ki=2 nM) with anti-tumor activities· Merestinib dihydrochloride also has potent activity against MST1R (IC50=11 nM), FLT3 (IC50=7 nM), AXL (IC50=2 nM), MERTK (IC50=10 nM), TEK (IC50=63 nM), ROS1, DDR1/2 (IC50=0·1/7 nM) and MKNK1/2 (IC50=7 nM)

ChemicalCAS1206801-37-7MW625.45FormulaC30H24Cl2F2N6O3
CAS number
1206801-37-7
Molecular weight
625.45
Formula
C30H24Cl2F2N6O3
Solubility
DMSO： ≥ 100 mg/mL (159·88 mM)
InChIKey
NNYNNMGUBHQQLZ-UHFFFAOYSA-N
Catalogue number
GC36585
Brand
GLPBIO
Computed properties PubChem CID 71604306 · TPSA 105 Ų · H-bond donors 4 · H-bond acceptors 7
TPSA
105 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
43

SMILES CC1=CC=C(C(=O)N1C2=CC=C(C=C2)F)C(=O)NC3=CC(=C(C=C3)OC4=C(C=C5C(=C4)C=NN5C)C6=CNN=C6)F.Cl.Cl

Computed descriptors from PubChem (CID 71604306), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Pricing
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Documents
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