CymitQuimica logo

CAS 87253-83-6

:

1,3,4-Thiadiazolo[3,2-a]pyrimidin-4-ium, 5,7-dimethyl-2-thioxo-, inner salt

Description:
1,3,4-Thiadiazolo[3,2-a]pyrimidin-4-ium, 5,7-dimethyl-2-thioxo-, inner salt, identified by CAS number 87253-83-6, is a heterocyclic compound featuring a fused thiadiazole and pyrimidine ring system. This compound is characterized by its unique structural framework, which includes a thioxo group and a quaternary ammonium structure, contributing to its potential biological activity. The presence of methyl groups at the 5 and 7 positions enhances its lipophilicity, potentially influencing its solubility and permeability in biological systems. As an inner salt, it exhibits ionic characteristics, which may affect its stability and reactivity. This compound is of interest in medicinal chemistry due to its potential pharmacological properties, including antimicrobial and antitumor activities. Its synthesis typically involves multi-step reactions that introduce the thiadiazole and pyrimidine functionalities. Overall, the unique structural and chemical properties of this compound make it a subject of interest for further research in various fields, including drug development and material science.
Formula:C7H7N3S2
InChI:InChI=1S/C7H7N3S2/c1-4-3-5(2)10-6(8-4)12-7(11)9-10/h3H,1-2H3
InChI key:InChIKey=JQJIIAGVULRAON-UHFFFAOYSA-N
SMILES:CC1=[N+]2C(SC(=S)[N-]2)=NC(C)=C1
Synonyms:
  • 1,3,4-Thiadiazolo[3,2-a]pyrimidin-4-ium, 5,7-dimethyl-2-thioxo-, inner salt
  • 5,7-Dimethyl[1,3,4]thiadiazolo[3,2-a]pyrimidinium-2-thiolate
  • 1,3,4-Thiadiazolo[3,2-a]pyrimidin-4-ium, 2,3-dihydro-5,7-dimethyl-2-thioxo-, inner salt
  • [5,7-Dimethyl-4λ5-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ylium-2-yl]sulfanide
Sort by
Purity (%)
0
100
|
0
|
50
|
90
|
95
|
100
Found 2 products.