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302561-39-3

302561-39-3 structural image
Product Name: cyclopentyl 4-(3-bromo-4-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Formula: C18H21BrN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 409.3 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 408.06847 g/mol
Monoisotopic Mass 408.06847 g/mol
Topological Polar Surface Area 76.7 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 559
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