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CS-W001157 4
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(1S,2R,4S,5R)-1-(2-((4-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide

  • CAS No. 2798945-99-8

  • Cat. No. CS-0880301
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

(1S,2R,4S,5R)-1-(2-((4-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide|CS-0880301

Structure of 2798945-99-8

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General Information

  • CAS No. 2798945-99-8
  • Cat. No. CS-0880301
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃₁H₃₈BrN₃O₂
  • Molecular Weight 564.56
  • Synonym(s) None
  • SMILES O[C@H]([C@@H]1[N@@+](C[C@@H]2C=C)(CC(NC3=CC=C(C(C)(C)C)C=C3)=O)CC[C@H]2C1)C4=CC=NC5=C4C=CC=C5.[Br-]

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   62.22
  • LogP   2.6196
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   6

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