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228544-65-8

228544-65-8 structural image
Product Name: N-[2,6-BIS(1-METHYLETHYL)PHENYL]-N'-[4-[(4-NITROPHENYL)THIO]PHENYL]UREA
Formula: C25H27N3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 449.6 g/mol
XLogP3 6.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 449.17731291 g/mol
Monoisotopic Mass 449.17731291 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 592
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

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