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530122-85-1

530122-85-1 structural image
Product Name: 1-[(E)-[3-[(1,3-dioxoisoindol-2-yl)methyl]-4-methoxyphenyl]methylideneamino]-3-phenylthiourea
Formula: C24H20N4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 444.5 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 444.12561169 g/mol
Monoisotopic Mass 444.12561169 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 700
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes