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CS-W001157 4
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(2S,3S)-2-(4-Methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate Diltiazem Impurity

  • CAS No. 87447-47-0

  • Cat. No. CS-0531667
  • Molecule weight343.40
  • Purity≥98%
  • MDL No.None

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

(2S,3S)-2-(4-Methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate Diltiazem Impurity|CS-0531667

Structure of 87447-47-0

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General Information

  • CAS No. 87447-47-0
  • Cat. No. CS-0531667
  • Purity ≥98%
  • MDL No. None
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₇NO₄S
  • Molecular Weight 343.40
  • Synonym(s) Des[5-(2-dimethylamino)ethyl] Diltiazem
  • SMILES CC(O[C@@H]1[C@@](C2=CC=C(C=C2)OC)([H])SC3=CC=CC=C3NC1=O)=O

Synthesis

  • Route1
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      97859-66-0
    • ~%
    • In-stock
      (2S,3S)-2-(4-Methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate Diltiazem Impurity|CS-0531667
      87447-47-0

    References

    • Synthetic Communications, , vol. 20, # 15 p. 2365 - 2371

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   64.63
  • LogP   3.4124
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   3

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