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tert-Butyl (thiazol-5-ylmethyl) ((2S,3S,5S)-3-hydroxy-1,6-diphenylhexane-2,5-diyl)dicarbamate Ritonavir Impurity

  • CAS No. 162849-95-8

  • Cat. No. CS-0437853
  • Purity≥98%
  • MDL No.None

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

tert-Butyl (thiazol-5-ylmethyl) ((2S,3S,5S)-3-hydroxy-1,6-diphenylhexane-2,5-diyl)dicarbamate Ritonavir Impurity|CS-0437853

Structure of 162849-95-8

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General Information

  • CAS No. 162849-95-8
  • Cat. No. CS-0437853
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₈H₃₅N₃O₅S
  • Molecular Weight 525.66
  • Synonym(s) thiazol-5-ylmethyl (2S,3S,5S)-5-tert-butoxycarbonylamino-3-hydroxy-1,6-diphenylhexan-2-ylcarbamate
  • SMILES O=C(OCC1=CN=CS1)N[C@@H](CC2=CC=CC=C2)[C@@H](O)C[C@@H](NC(OC(C)(C)C)=O)CC3=CC=CC=C3

Synthesis

  • Route1

    References

    • GILEAD SCIENCES, INC.; CULLEN, Aaron, J.; YU, Richard, Hung Chiu Patent: WO2013/116715 A1, 2013 ; Location in patent: Page/Page column 70 ;
  • Route2
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      1448312-70-6
    • tert-Butyl (thiazol-5-ylmethyl) ((2S,3S,5S)-3-hydroxy-1,6-diphenylhexane-2,5-diyl)dicarbamate Ritonavir Impurity|CS-0437853
      162849-95-8

    References

    • GILEAD SCIENCES, INC.; CULLEN, Aaron, J.; YU, Richard, Hung Chiu Patent: WO2013/116715 A1, 2013 ; Location in patent: Page/Page column 71-72 ;

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   109.78
  • LogP   4.8676
  • H_Acceptors   7
  • H_Donors   3
  • Rotatable_Bonds   11

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