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883042-74-8

883042-74-8 structural image
Product Name: 3-(4-BROMO-3-METHYLPHENYL)-2-THIOXO-2,3-DIHYDRO-4(1H)-QUINAZOLINONE
Formula: C15H11BrN2OS
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COMPUTED DESCRIPTORS

Molecular Weight 347.2 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 345.97755 g/mol
Monoisotopic Mass 345.97755 g/mol
Topological Polar Surface Area 64.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 417
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