4-[4-[[5-fluoro-4-[3-(prop-2-enoylamino)anilino]pyrimidin-2-yl]amino]phenoxy]-N-methylpyridine-2-carboxamide


Chemical Name: 4-[4-[[5-fluoro-4-[3-(prop-2-enoylamino)anilino]pyrimidin-2-yl]amino]phenoxy]-N-methylpyridine-2-carboxamide
CAS Number: 1202759-32-7
Product Number: AG008TF2(AGN-PC-0CT5ML)
Synonyms:
MDL No:
Molecular Formula: C26H22FN7O3
Molecular Weight: 499.4964

Identification/Properties


Computed Properties
Molecular Weight:
499.506g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
9
Exact Mass:
499.177g/mol
Monoisotopic Mass:
499.177g/mol
Topological Polar Surface Area:
130A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
767
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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