1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione

Base Information

• Chemical Name: 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione
• CAS No.: 1029075-66-8
• Molecular Formula: C₁₅H₁₄N₈O₂S
• Molecular Weight: 370.395
• Mol file: 1029075-66-8.mol

Synonyms:1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione

Chemical Property of 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione

There total 4 articles about 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 85.0%

1-[4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-(4H,6H)-dione]acetyl 4-phenyl thiosemicarbazide (1029075-55-5) → 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione (1029075-66-8)

Guidance literature:

With sodium hydroxide; for 3h; Heating;

DOI:10.1007/s00706-007-0649-7

Reference yield:

C8H11N7O3 (1029075-53-3) → 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione (1029075-66-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 92 percent / ethanol / 1 h / Heating

2: 85 percent / aq. NaOH / 3 h / Heating

With sodium hydroxide; In ethanol;

DOI:10.1007/s00706-007-0649-7

Reference yield:

1-carbethoxymethyl-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-(4H,6H)-dione (32600-59-2) → 1-[(5-mercapto-4-phenyl-1,2,4-triazol-3-yl)methyl]-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione (1029075-66-8)

Guidance literature:

Multi-step reaction with 3 steps

1: 89 percent / hydrazine hydrate / ethanol / 3 h / Heating

2: 92 percent / ethanol / 1 h / Heating

3: 85 percent / aq. NaOH / 3 h / Heating

With sodium hydroxide; hydrazine hydrate; In ethanol;

DOI:10.1007/s00706-007-0649-7

upstream raw materials:

1-[4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-(4H,6H)-dione]acetyl 4-phenyl thiosemicarbazide

C₈H₁₁N₇O₃

1-carbethoxymethyl-4,6-dimethyl-1H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-(4H,6H)-dione

6-azido-1,3-dimethylpyrimidine-2,4(1H,3H)-dione

Downstream raw materials:

C₁₉H₂₀N₈O₄S

C₁₇H₁₈N₁₀O₃S