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1314014-68-0

1314014-68-0 structural image
Product Name: N-[(2S)-1-[(3-chlorophenyl)methylamino]-1-oxopropan-2-yl]-4-phenylpiperazine-1-carboxamide
Formula: C21H25ClN4O2
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COMPUTED DESCRIPTORS

Molecular Weight 400.9 g/mol
XLogP3 3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 400.1666037 g/mol
Monoisotopic Mass 400.1666037 g/mol
Topological Polar Surface Area 64.7 Ų
Heavy Atom Count 28
Formal Charge 0
Complexity 519
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes