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478065-39-3

478065-39-3 structural image
Product Name: Ethyl 4-(3-([(4-methoxyphenyl)sulfonyl]amino)phenoxy)-2-(methylsulfanyl)-5-pyrimidinecarboxylate
Formula: C21H21N3O6S2
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COMPUTED DESCRIPTORS

Molecular Weight 475.5 g/mol
XLogP3 3.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 10
Exact Mass 475.08717775 g/mol
Monoisotopic Mass 475.08717775 g/mol
Topological Polar Surface Area 150 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 696
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