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250713-96-3

250713-96-3 structural image
Product Name: 8-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-PHENYL-1,2,4,8-TETRAAZASPIRO[4.5]DECAN-3-ONE
Formula: C18H17ClF3N5O
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COMPUTED DESCRIPTORS

Molecular Weight 411.8 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 411.1073724 g/mol
Monoisotopic Mass 411.1073724 g/mol
Topological Polar Surface Area 60.5 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 578
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