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2-amino-3-benzoyl-6-methoxy-quinazolin-4-one 52393-74-5 98%
Identification and Related Records
【Name】
2-amino-3-benzoyl-6-methoxy-quinazolin-4-one
【CAS Registry number】
52393-74-5
【Synonyms】
NSC311359
AC1L74IV
NSC-311359
2-amino-3-benzoyl-6-methoxyquinazolin-4-one
52393-74-5
【Molecular Formula】
C16H13N3O3 (Products with the same molecular formula)
【Molecular Weight】
295.29272
Chemical and Physical Properties
【Computed Properties】
Molecular Weight:295.29272 [g/mol]
Molecular Formula:C16H13N3O3
XLogP3-AA:2.3
H-Bond Donor:1
H-Bond Acceptor:4
Rotatable Bond Count:2
Tautomer Count:5
Exact Mass:295.095691
MonoIsotopic Mass:295.095691
Topological Polar Surface Area:85
Heavy Atom Count:22
Formal Charge:0
Complexity:485
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
Feature 3D Acceptor Count:3
Feature 3D Donor Count:1
Feature 3D Ring Count:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:7
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