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1024482-77-6

1024482-77-6 structural image
Product Name: 4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))-1-(2-NAPHTHYLSULFONYL)-1,4-DIAZAPERHYDROEPINE
Formula: C21H19ClF3N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 469.9 g/mol
XLogP3 5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 469.0838602 g/mol
Monoisotopic Mass 469.0838602 g/mol
Topological Polar Surface Area 61.9 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 718
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