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129166-25-2

129166-25-2 structural image
Product Name: 1,3-Dihydro-7-bromo-5-(2-chlorophenyl)-3-hydroxy-1-methyl-2H-1,4-benzo diazepin-2-one
Formula: C16H12BrClN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 379.63 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 377.97707 g/mol
Monoisotopic Mass 377.97707 g/mol
Topological Polar Surface Area 52.9 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 473
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes