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1023556-71-9

1023556-71-9 structural image
Product Name: 4-((((2-INDOL-3-YLETHYL)AMINO)THIOXOMETHYL)AMINO)BENZENECARBONITRILE
Formula: C18H16N4S
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COMPUTED DESCRIPTORS

Molecular Weight 320.4 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 320.10956770 g/mol
Monoisotopic Mass 320.10956770 g/mol
Topological Polar Surface Area 95.7 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 449
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