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Homecas250713-97-4

250713-97-4

250713-97-4 structural image
Product Name: 2,8-BIS[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-1,2,4,8-TETRAAZASPIRO[4.5]DECAN-3-ONE
Formula: C18H14Cl2F6N6O
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COMPUTED DESCRIPTORS

Molecular Weight 515.2 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 2
Exact Mass 514.0510335 g/mol
Monoisotopic Mass 514.0510335 g/mol
Topological Polar Surface Area 73.4 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 734
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