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36116-31-1

36116-31-1 structural image
Product Name: 5-chloro-7-[[4-[ethyl(2-hydroxyethyl)amino]-2-benzyl]azo]-1,3-dimethyl-1H-benzimidazolium chloride
Formula: C20H25Cl2N5O
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COMPUTED DESCRIPTORS

Molecular Weight 422.3 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 421.1436158 g/mol
Monoisotopic Mass 421.1436158 g/mol
Topological Polar Surface Area 57 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 507
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