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Chemical structure of Vandetanib trifluoroacetate

GC37886

Vandetanib trifluoroacetate

Also known as N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine;2,2,2-trifluoroacetic acid

Vandetanib trifluoroacetate (D6474 trifluoroacetate) is a potent, orally active inhibitor of VEGFR2/KDR tyrosine kinase activity (IC50=40 nM)· Vandetanib trifluoroacetate also has activity versus the tyrosine kinase activity of VEGFR3/FLT4 (IC50=110 nM) and EGFR/HER1 (IC50=500 nM)

ChemicalCAS338992-53-3MW589.38FormulaC24H25BrF4N4O4
CAS number
338992-53-3
Molecular weight
589.38
Formula
C24H25BrF4N4O4
Solubility
Soluble in DMSO
InChIKey
FZMIEQCEGTVFBZ-UHFFFAOYSA-N
Catalogue number
GC37886
Brand
GLPBIO
Computed properties PubChem CID 17973223 · TPSA 96.8 Ų · H-bond donors 2 · H-bond acceptors 12
TPSA
96.8 Ų
H-bond donors
2
H-bond acceptors
12
Rotatable bonds
6
Heavy atoms
37

SMILES CN1CCC(CC1)COC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Br)F)OC.C(=O)(C(F)(F)F)O

Computed descriptors from PubChem (CID 17973223), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Pricing
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Documents
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