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77420-13-4

77420-13-4 structural image
Product Name: 4H-Furo(2,3-b)(1,5)benzodiazepin-4-one, 2,3,3a,5-tetrahydro-3a-ethyl-2 -methyl-
Formula: C14H16N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 244.29 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 244.121177757 g/mol
Monoisotopic Mass 244.121177757 g/mol
Topological Polar Surface Area 50.7 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 393
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes