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2190506-55-7

2190506-55-7 structural image
Product Name: tert-butyl 4-(3-cyano-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidin-7-yl)piperidine-1-carboxylate
Formula: C29H29N5O3
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COMPUTED DESCRIPTORS

Molecular Weight 495.6 g/mol
XLogP3 4.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 495.22703980 g/mol
Monoisotopic Mass 495.22703980 g/mol
Topological Polar Surface Area 92.8 Ų
Heavy Atom Count 37
Formal Charge 0
Complexity 815
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

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