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218457-53-5

218457-53-5 structural image
Product Name: N1-(TERT-BUTYL)-2-(3,5-DIBROMO-2-HYDROXYBENZYLIDENE)HYDRAZINE-1-CARBOTHIOAMIDE
Formula: C12H15Br2N3OS
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COMPUTED DESCRIPTORS

Molecular Weight 409.14 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 408.92821 g/mol
Monoisotopic Mass 406.93026 g/mol
Topological Polar Surface Area 88.7 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 346
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