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Chemical structure of Zeteletinib

GC64340

Zeteletinib

Also known as 2-[6-(6,7-dimethoxyquinolin-3-yl)-3-pyridinyl]-N-[3-(1,1,1-trifluoro-2-methylpropan-2-yl)-1,2-oxazol-5-yl]acetamide

Zeteletinib (BOS-172738; DS-5010) is an orally active, selective RET kinase inhibitor with nanomolar potency against RET and >300-fold selectivity against VEGFR2· Zeteletinib shows exquisite potency for the wild type RET, RETV804M/L gatekeeper mutants, and the most common oncogenic RET mutation M918T· Zeteletinib has potent antitumor activity

ChemicalCAS2216753-97-6MW500.47FormulaC25H23F3N4O4
CAS number
2216753-97-6
Molecular weight
500.47
Formula
C25H23F3N4O4
InChIKey
KOLQINCWMXQEOF-UHFFFAOYSA-N
Catalogue number
GC64340
Brand
GLPBIO
Computed properties PubChem CID 134391533 · XLogP 4.6 · TPSA 99.4 Ų · H-bond donors 1
XLogP
4.6
TPSA
99.4 Ų
H-bond donors
1
H-bond acceptors
10
Rotatable bonds
7
Heavy atoms
36

SMILES CC(C)(C1=NOC(=C1)NC(=O)CC2=CN=C(C=C2)C3=CN=C4C=C(C(=CC4=C3)OC)OC)C(F)(F)F

Computed descriptors from PubChem (CID 134391533), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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