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2-(4-Methoxyphenyl)-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one

  • CAS No. 77261-89-3

  • Cat. No. CS-0541171
  • Molecule weight285.36
  • Purity≥98%
  • MDL No.None

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

2-(4-Methoxyphenyl)-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one|CS-0541171

Structure of 77261-89-3

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General Information

  • CAS No. 77261-89-3
  • Cat. No. CS-0541171
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₁₅NO₂S
  • Molecular Weight 285.36
  • Synonym(s) 2-(4-Methoxyphenyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
  • SMILES O=C1CC(C2=CC=C(OC)C=C2)SC3=CC=CC=C3N1

Synthesis

  • Route1

    References

    • Krapcho,J. et al. Journal of Medicinal Chemistry, 1963 , vol. 6, p. 544 - 546

Safety Information

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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   38.33
  • LogP   3.8708
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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