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876667-86-6

876667-86-6 structural image
Product Name: 11-methyl-3-phenyl-2,3,4,5-tetrahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Formula: C20H18N2O
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COMPUTED DESCRIPTORS

Molecular Weight 302.4 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 302.141913202 g/mol
Monoisotopic Mass 302.141913202 g/mol
Topological Polar Surface Area 41.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 542
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