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878113-83-8

878113-83-8 structural image
Product Name: 5-Bromo-N-(4-chloro-benzyl)-nicotinamide
Formula: C13H10BrClN2O
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COMPUTED DESCRIPTORS

Molecular Weight 325.59 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 323.96650 g/mol
Monoisotopic Mass 323.96650 g/mol
Topological Polar Surface Area 42 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 282
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