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87654-80-6

87654-80-6 structural image
Product Name: 2-(4-Chlorophenoxy)-N-(2-(hexahydro-4-methyl-1H-1,4-diazepin-1-yl)ethy l)acetamide 2HCl
Formula: C16H26Cl3N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 398.8 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 397.109060 g/mol
Monoisotopic Mass 397.109060 g/mol
Topological Polar Surface Area 44.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 335
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 3
Compound Is Canonicalized Yes