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958950-39-5

958950-39-5 structural image
Product Name: N-[(2S)-1-(furan-2-ylmethylamino)-3-methyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide
Formula: C23H31N3O5S
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COMPUTED DESCRIPTORS

Molecular Weight 461.6 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 461.19844227 g/mol
Monoisotopic Mass 461.19844227 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 735
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