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1449480-55-0

1449480-55-0 structural image
Product Name: N-[(1S,2S)-2-[[[[(1S,2S)-2-(diMethylaMino)cyclohexyl]aMino]thioxoMethyl]aMino]-1,2-diphenylet
Formula: C31H34F6N4O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 672.8 g/mol
XLogP3 6.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 9
Exact Mass 672.20273766 g/mol
Monoisotopic Mass 672.20273766 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1030
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes