N-Formyl Varenicline


Chemical Name: N-Formyl Varenicline
CAS Number: 796865-82-2
Product Number: AG008LNB(AGN-PC-05J3AN)
Synonyms:
MDL No:
Molecular Formula: C14H13N3O
Molecular Weight: 239.2725

Identification/Properties


Computed Properties
Molecular Weight:
239.278g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
239.106g/mol
Monoisotopic Mass:
239.106g/mol
Topological Polar Surface Area:
46.1A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
320
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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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