LGX-818 (Encorafenib)


Chemical Name: LGX-818 (Encorafenib)
CAS Number: 1269440-17-6
Product Number: AG000WF7(AGN-PC-0WAJPN)
Synonyms:
MDL No:
Molecular Formula: C22H27ClFN7O4S
Molecular Weight: 540.0107

Identification/Properties


Computed Properties
Molecular Weight:
540.011g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
10
Exact Mass:
539.152g/mol
Monoisotopic Mass:
539.152g/mol
Topological Polar Surface Area:
149A^2
Heavy Atom Count:
36
Formal Charge:
0
Complexity:
836
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


Other Analytical Data


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