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886503-95-3

886503-95-3 structural image
Product Name: 4-(2-[2-(4-HYDROXY-3-METHOXY-PHENYL)-VINYL]-4-OXO-4 H-QUINAZOLIN-3-YL)-BENZOIC ACID
Formula: C24H18N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 414.4 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 414.12157168 g/mol
Monoisotopic Mass 414.12157168 g/mol
Topological Polar Surface Area 99.4 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 728
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes