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4005-05-4

4005-05-4 structural image
Product Name: 4-(2-METHYL-4-OXO-4 H-QUINAZOLIN-3-YL)-BENZOIC ACID
Formula: C16H12N2O3
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COMPUTED DESCRIPTORS

Molecular Weight 280.28 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 280.08479225 g/mol
Monoisotopic Mass 280.08479225 g/mol
Topological Polar Surface Area 70 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 466
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