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865181-92-6

865181-92-6 structural image
Product Name: (Z)-3-bromo-N-(3-(prop-2-yn-1-yl)-6-sulfamoylbenzo[d]thiazol-2(3H)-ylidene)benzamide
Formula: C17H12BrN3O3S2
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COMPUTED DESCRIPTORS

Molecular Weight 450.3 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 448.95035 g/mol
Monoisotopic Mass 448.95035 g/mol
Topological Polar Surface Area 127 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 740
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