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338794-04-0

338794-04-0 structural image
Product Name: 7-CHLORO-2-METHYL-3-(1H-1,2,4-TRIAZOL-3-YL)-4(3H)-QUINAZOLINONE
Formula: C11H8ClN5O
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COMPUTED DESCRIPTORS

Molecular Weight 261.67 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 261.0417376 g/mol
Monoisotopic Mass 261.0417376 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 388
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