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941236-38-0

941236-38-0 structural image
Product Name: 9-benzyl-2-(4-methylpiperidin-1-yl)-4-oxo-1,3,9-triazaspiro[5.5]undec-1-ene-5-carbonitrile
Formula: C22H29N5O
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COMPUTED DESCRIPTORS

Molecular Weight 379.5 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 379.23721057 g/mol
Monoisotopic Mass 379.23721057 g/mol
Topological Polar Surface Area 71.7 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 643
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes