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842972-96-7

842972-96-7 structural image
Product Name: 3-[6-(4-chloro-3-methylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one
Formula: C28H29ClN2O3
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COMPUTED DESCRIPTORS

Molecular Weight 477.0 g/mol
XLogP3 6.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 10
Exact Mass 476.1866705 g/mol
Monoisotopic Mass 476.1866705 g/mol
Topological Polar Surface Area 51.1 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 679
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