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726199-29-7

726199-29-7 structural image
Product Name: ethyl 6-oxo-2-(4-phenylpiperazin-1-yl)-1H-pyrimidine-5-carboxylate
Formula: C17H20N4O3
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COMPUTED DESCRIPTORS

Molecular Weight 328.4 g/mol
XLogP3 1.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 328.15354051 g/mol
Monoisotopic Mass 328.15354051 g/mol
Topological Polar Surface Area 74.2 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 544
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