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2-Amino-6,7-dihydrobenzo[d]thiazol-4(5H)-one

  • CAS No. 36234-66-9

  • Cat. No. CS-0155449
  • Molecule weight168.22
  • Purity≥95%
  • MDL No.MFCD21117211

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

2-Amino-6,7-dihydrobenzo[d]thiazol-4(5H)-one|CS-0155449

Structure of 36234-66-9

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General Information

  • CAS No. 36234-66-9
  • Cat. No. CS-0155449
  • Purity ≥95%
  • MDL No. MFCD21117211
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈N₂OS
  • Molecular Weight 168.22
  • Synonym(s) 2-aMino-6,7-dihydro-5H-benzothiazol-4-one
  • SMILES O=C1CCCC2=C1N=C(N)S2

Description

2-Amino-6,7-dihydrobenzo[d]thiazol-4(5H)-one features a fused heterocyclic core with a strategically positioned amino group enhancing nucleophilicity and solubility. This bench-stable scaffold integrates readily into bioactive molecule design, offering a robust platform for medicinal chemistry campaigns targeting kinase inhibition and antimicrobial agents.

Application

2-Amino-6,7-dihydrobenzo[d]thiazol-4(5H)-one serves as a versatile scaffold for the synthesis of biologically active heterocycles, enabling efficient access to thiazole-based medicinal compounds. Its amine and carbonyl functionalities support diverse functionalization, including amidation and alkylation, while the saturated thiazole ring enhances stability and solubility. The compound exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis in drug discovery 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   55.98
  • LogP   1.2443
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   0

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