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329929-24-0

329929-24-0 structural image
Product Name: 2-[4-(3-CHLOROPHENYL)PIPERAZINO]-4-(4-ETHOXYPHENYL)-4-OXOBUTANOIC ACID
Formula: C22H25ClN2O4
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COMPUTED DESCRIPTORS

Molecular Weight 416.9 g/mol
XLogP3 1.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 416.1502850 g/mol
Monoisotopic Mass 416.1502850 g/mol
Topological Polar Surface Area 70.1 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 545
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