Regorafenib(monohydrate)


Chemical Name: Regorafenib(monohydrate)
CAS Number: 1019206-88-2
Product Number: AG008TJC(AGN-PC-0WNHEM)
Synonyms:
MDL No:
Molecular Formula: C21H17ClF4N4O4
Molecular Weight: 500.8307

Identification/Properties


Computed Properties
Molecular Weight:
500.835g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
5
Exact Mass:
500.087g/mol
Monoisotopic Mass:
500.087g/mol
Topological Polar Surface Area:
93.4A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
686
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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