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860789-49-7

860789-49-7 structural image
Product Name: 2-[(MESITYLMETHYL)SULFANYL]-6,7-DIMETHOXY-3-OCTYL-4(3H)-QUINAZOLINIMINE
Formula: C28H39N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 481.7 g/mol
XLogP3 7.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 12
Exact Mass 481.27629867 g/mol
Monoisotopic Mass 481.27629867 g/mol
Topological Polar Surface Area 83.2 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 660
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