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170229-03-5

170229-03-5 structural image
Product Name: 1-METHYL-5-PHENYL-1,3-DIHYDRO-2H-1,4-BENZODIAZEPIN-2-ONE
Formula: C16H16N2O
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COMPUTED DESCRIPTORS

Molecular Weight 252.31 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 252.126263138 g/mol
Monoisotopic Mass 252.126263138 g/mol
Topological Polar Surface Area 32.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 325
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