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1240670-85-2

1240670-85-2 structural image
Product Name: 1-[2-[(2,4-diMethylphenyl)thio]phenyl]-4-[2-(1-piperazinyl)phenyl]- Piperazine
Formula: C28H34N4S
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COMPUTED DESCRIPTORS

Molecular Weight 458.7 g/mol
XLogP3 5.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 458.25041828 g/mol
Monoisotopic Mass 458.25041828 g/mol
Topological Polar Surface Area 47 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 588
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes