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301330-96-1

301330-96-1 structural image
Product Name: methyl 4-(3,4-dihydroxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Formula: C14H16N2O5
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COMPUTED DESCRIPTORS

Molecular Weight 292.29 g/mol
XLogP3 0.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 292.10592162 g/mol
Monoisotopic Mass 292.10592162 g/mol
Topological Polar Surface Area 99.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 476
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