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PD224378

PD224378 structure

PD224378 

structure
  • CAS No:

    501665-88-9

  • Formula:

    C20H35NO11

  • Chemical Name:

    PD224378

  • Synonyms:

    (4R)-1-(4-O-b-D-Galactopyranosyl-b-D-glucopyranosyl)-4-(2-methylpropyl)-2-pyrrolidinone;(4R)-1-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]-4-(2-methylpropyl)pyrrolidin-2-one;PD 224378;Pregabalin conjugate PD0224378;(R)-1-((2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)-4-isobutylpyrrolidin-2-one;(4R)-1-(4-O-β-D-Galactopyranosyl-β-D-glucopyranosyl)-4-(2-methylpropyl)-2-pyrrolidinone;Pregabalin Amide Lactose Adduct;2-Pyrrolidinone, 1-(4-O-β-D-galactopyranosyl-β-D-glucopyranosyl)-4-(2-methylpropyl)-, (4R)-

PD224378 Basic Attributes

465.5

465.22101093

Characteristics

1.49±0.1 g/cm3

751.9±60.0 °C(Predicted)

12.88±0.70

PD224378 Use and Manufacturing

Impurity in commercial preparations of Pregabalin

Computed Properties

Molecular Weight:465.5
XLogP3:-2.9
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:465.22101093
Monoisotopic Mass:465.22101093
Topological Polar Surface Area:190
Heavy Atom Count:32
Complexity:637
Defined Atom Stereocenter Count:11
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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