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157199-63-8

157199-63-8 structural image
Product Name: 3-METHYL-2-((E)-3-[1-[3-(TRIMETHYLAMMONIO)PROPYL]-4(1H)-QUINOLINYLIDENE]-1-PROPENYL)-1,3-BENZOTHIAZOL-3-IUM DIIODIDE
Formula: C26H31I2N3S
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COMPUTED DESCRIPTORS

Molecular Weight 671.4 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 671.03281 g/mol
Monoisotopic Mass 671.03281 g/mol
Topological Polar Surface Area 32.4 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 622
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 2
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes