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537680-61-8

537680-61-8 structural image
Product Name: 4-(4-chloro-3-nitrophenyl)-N-(2,5-dimethylphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Formula: C20H19ClN4O3S
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COMPUTED DESCRIPTORS

Molecular Weight 430.9 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 430.0866393 g/mol
Monoisotopic Mass 430.0866393 g/mol
Topological Polar Surface Area 131 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 710
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