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3-Chloro-6-methyldibenzo[c,f][1,2]thiazepin-11(6H)-one 5,5-dioxide

  • CAS No. 26638-53-9

  • Cat. No. CS-0144521
  • Purity≥96%
  • MDL No.MFCD07368146

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

3-Chloro-6-methyldibenzo[c,f][1,2]thiazepin-11(6H)-one 5,5-dioxide|CS-0144521

Structure of 26638-53-9

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General Information

  • CAS No. 26638-53-9
  • Cat. No. CS-0144521
  • Purity ≥96%
  • MDL No. MFCD07368146
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₀ClNO₃S
  • Molecular Weight 307.75
  • Synonym(s) 3-Chloro-6-methyl-S,S-dioxyde-dibenzo[c,f]thiazepin-11(6H)-one
  • SMILES O=C(C1=CC=C(Cl)C=C12)C3=CC=CC=C3N(C)S2(=O)=O

Description

This dibenzothiazepinone derivative features a sterically hindered, electron-deficient core with a bench-stable sulfone moiety and a methyldihydrobenzene scaffold. The 3-chloro and 6-methyl substituents provide directional control for regioselective functionalization, while the 5,5-dioxide group enhances solubility and metabolic stability. Ideal for probing heterocyclic reactivity in medicinal chemistry workflows.

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 : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   54.45
  • LogP   2.7095
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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