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331235-68-8

331235-68-8 structural image
Product Name: ethyl 4-(5-bromo-2-hydroxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Formula: C15H17BrN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 369.21 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 368.03717 g/mol
Monoisotopic Mass 368.03717 g/mol
Topological Polar Surface Area 78.9 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 494
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