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ValdecoxibIMpurityB

ValdecoxibIMpurityB structure

ValdecoxibIMpurityB 

structure
  • CAS No:

    1373038-60-8

  • Formula:

    C32H25N3O6S2

  • Chemical Name:

    ValdecoxibIMpurityB

  • Synonyms:

    Valdecoxib DiMer,Valdecoxib IMpurity B;4-(5-methyl-3-phenylisoxazol-4-yl)-N-((4-(5-methyl-3-phenylisoxazol-4-yl)phenyl)sulfonyl)benzenesulfonamide;N-[4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulfonyl]-4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulfonaMide;Valdecoxib DiMer;Valdecoxib IMpurity B;Valdecoxib IMpurity-B(valdecoxib DiMer);BenzenesulfonaMide, 4-(5-Methyl-3-phenyl-4-isoxazolyl)-N-[[4-(5-Methyl-3-phenyl-4-isoxazolyl)phenyl]sulfonyl]-;Parecoxib Sodium Impurity 13

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

ValdecoxibIMpurityB Basic Attributes

611.69

611.11847787

Characteristics

1.343±0.06 g/cm3

732.7±70.0 °C(Predicted)

-4.23±0.40

ValdecoxibIMpurityB Use and Manufacturing

Valdecoxib Dimer is a dimeric impurity of the cyclooxygenase-2 inhibitor, Valdecoxib (V090000).

Computed Properties

Molecular Weight:611.7
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:611.11847787
Monoisotopic Mass:611.11847787
Topological Polar Surface Area:149
Heavy Atom Count:43
Complexity:1020
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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