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872547-04-1

872547-04-1 structural image
Product Name: N-(4-fluorophenyl)-4-pyrrolidin-1-yl-6-[4-(2H-tetrazol-5-yl)phenoxy]-1,3,5-triazin-2-amine
Formula: C20H18FN9O
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COMPUTED DESCRIPTORS

Molecular Weight 419.4 g/mol
XLogP3 4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 6
Exact Mass 419.16183439 g/mol
Monoisotopic Mass 419.16183439 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 553
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