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86759-10-6

86759-10-6 structural image
Product Name: 1-Piperazinamine, 4-(8-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)- N-((4-(2-(dimethylamino)ethoxy)-3-ethoxyphenyl)methylene)-, dihydrochl oride, hydrate
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COMPUTED DESCRIPTORS

Molecular Weight 638.1 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 9
Exact Mass 636.185931 g/mol
Monoisotopic Mass 636.185931 g/mol
Topological Polar Surface Area 65.8 Ų
Heavy Atom Count 41
Formal Charge 0
Complexity 767
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes