LDK378 2HCl (Ceritinib)


Chemical Name: LDK378 2HCl (Ceritinib)
CAS Number: 1380575-43-8
Product Number: AG0017WX(AGN-PC-0WCY18)
Synonyms:
MDL No: MFCD26142928
Molecular Formula: C28H38Cl3N5O3S
Molecular Weight: 631.0570

Identification/Properties


Computed Properties
Molecular Weight:
631.054g/mol
Hydrogen Bond Donor Count:
5
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
9
Exact Mass:
629.176g/mol
Monoisotopic Mass:
629.176g/mol
Topological Polar Surface Area:
114A^2
Heavy Atom Count:
40
Formal Charge:
0
Complexity:
835
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:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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