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330785-82-5

330785-82-5 structural image
Product Name: 4-(3-chloro-4-MethoxybenzylaMino)-5-ethoxycarbonyl-2-MethylsulfinylpyriMidine
Formula: C16H18ClN3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 383.9 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 8
Exact Mass 383.0706549 g/mol
Monoisotopic Mass 383.0706549 g/mol
Topological Polar Surface Area 110 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 471
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes