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568553-08-2

568553-08-2 structural image
Product Name: 3-(1-METHYL-2-PHENYL-1H-INDOL-3-YL)-3-OXO-PROPIONITRILE
Formula: C18H14N2O
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COMPUTED DESCRIPTORS

Molecular Weight 274.3 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 274.110613074 g/mol
Monoisotopic Mass 274.110613074 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 432
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