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13545-96-5

13545-96-5 structural image
Product Name: 2-(3-Methyl-2-benzothiazidinylidene)-1-methylsulfonyl-1-phenylsulfonylhydrazine
Formula: C15H15N3O4S3
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COMPUTED DESCRIPTORS

Molecular Weight 397.5 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 397.02246949 g/mol
Monoisotopic Mass 397.02246949 g/mol
Topological Polar Surface Area 129 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 718
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes