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49799-48-6

49799-48-6 structural image
Product Name: 1,5-Dihydro-benzo[b][1,4]diazepine-2,4-dione
Formula: C9H8N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 176.17 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 176.058577502 g/mol
Monoisotopic Mass 176.058577502 g/mol
Topological Polar Surface Area 58.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 216
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