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CS-W001157 4
Total: USD 88.00

5,6-Dihydrobenzo[d]thiazol-7(4H)-one

  • CAS No. 935850-03-6

  • Cat. No. CS-0040558
  • Purity≥98%
  • MDL No.MFCD15071684

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

5,6-Dihydrobenzo[d]thiazol-7(4H)-one|CS-0040558

Structure of 935850-03-6

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General Information

  • CAS No. 935850-03-6
  • Cat. No. CS-0040558
  • Purity ≥98%
  • MDL No. MFCD15071684
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇NOS
  • Molecular Weight 153.20
  • Synonym(s) 5,6-Dihydrobenzothiazol-7(4H)-one
  • SMILES O=C1CCCC2=C1SC=N2

Description

5,6-Dihydrobenzo[d]thiazol-7(4H)-one features a fused heterocyclic core with a reducible thiazole ring and a carbonyl at the 7-position. This scaffold integrates readily into synthetic routes requiring electron-rich aromatic systems or polarizable heteroatoms. The compound exhibits stability under standard bench conditions and serves as a key intermediate in medicinal chemistry campaigns targeting kinase inhibitors and antimicrobial agents.

Application

5,6-Dihydrobenzo[d]thiazol-7(4H)-one serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient access to thiazole-based scaffolds. Its reactive enolizable carbonyl and adjacent sulfur atom facilitate electrophilic substitution, nucleophilic addition, and transition-metal-catalyzed coupling reactions. The compound exhibits good bench stability and compatibility with common protecting groups, making it suitable for multi-step synthesis and downstream derivatization in API development 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   29.96
  • LogP   1.6621
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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