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89647-52-9

89647-52-9 structural image
Product Name: 1H-1,5-Benzodiazepine-1-carboxamide, 2,3,4,5-tetrahydro-N,2-dimethyl-4-oxo-
Formula: C12H15N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 233.27 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 233.116426730 g/mol
Monoisotopic Mass 233.116426730 g/mol
Topological Polar Surface Area 61.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 319
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