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951950-71-3

951950-71-3 structural image
Product Name: N-(1,3-benzodioxol-5-yl)-2-[(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)oxy]acetamide
Formula: C22H21N3O5
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COMPUTED DESCRIPTORS

Molecular Weight 407.4 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 407.14812078 g/mol
Monoisotopic Mass 407.14812078 g/mol
Topological Polar Surface Area 89.5 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 698
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