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861211-97-4

861211-97-4 structural image
Product Name: 1-[(4-tert-butylphenyl)methyl]-2-(2-chloropyridin-3-yl)-1H-1,3-benzodiazole
Formula: C23H22ClN3
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COMPUTED DESCRIPTORS

Molecular Weight 375.9 g/mol
XLogP3 6.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 375.1502254 g/mol
Monoisotopic Mass 375.1502254 g/mol
Topological Polar Surface Area 30.7 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 483
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