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859114-54-8

859114-54-8 structural image
Product Name: 3-benzyl-9-(3,4-dimethoxyphenyl)-4-methyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-2-one
Formula: C27H25NO5
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COMPUTED DESCRIPTORS

Molecular Weight 443.5 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 443.17327290 g/mol
Monoisotopic Mass 443.17327290 g/mol
Topological Polar Surface Area 57.2 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 732
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