2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine

Base Information

• Chemical Name: 2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine
• CAS No.: 84746-24-7
• Molecular Formula: C₁₂H₁₄N₆
• Molecular Weight: 242.283
• Hs Code.: 2933599550
• European Community (EC) Number: 685-662-4
• UNII: XZ3J1GA4R4
• Mol file: 84746-24-7.mol

Synonyms:84746-24-7;2-[4-(pyrimidin-2-yl)piperazin-1-yl]pyrimidine;2,2'-(1,4-Piperazinediyl)bis-pyrimidine;2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine;XZ3J1GA4R4;1,4-Di(pyrimidin-2-yl)piperazine;2,2'-(Piperazine-1,4-diyl)dipyrimidine;Pyrimidine, 2,2'-(1,4-piperazinediyl)bis-;2,2'-(1,4-Piperazinediyl)bis [PYRIMIDINE];UNII-XZ3J1GA4R4;Buspirone Related Compound G;N,N'-bis-pyrimidylpiperazine;SCHEMBL10498542;MFCD04208147;AKOS001408102;BS-17576;CS-0161848;EN300-69940;D80929;SR-01000330254;SR-01000330254-1;Z31246726;2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine, 95%;BUSPIRONE HYDROCHLORIDE IMPURITY G [EP IMPURITY];Buspirone USP RC G;2,2?-(Piperazine-1,4-diyl)dipyrimidine;1,4-Bis(2-pyrimidinyl)piperazine

Chemical Property of 2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine

Chemical Property:

• Melting Point: 273-274 °C
• Boiling Point: 480.7±55.0 °C(Predicted)
• PKA: 5.17±0.33(Predicted)
• Density: 1.276±0.06 g/cm3(Predicted)
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Acetonitrile (Slightly), Chloroform (Slightly), DMSO (Slightly, Heated)
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 242.12799447
• Heavy Atom Count: 18
• Complexity: 215

Purity/Quality:

98% ^*data from raw suppliers

2,2’-(1,4-Piperazinediyl)bis-pyrimidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CN(CCN1C2=NC=CC=N2)C3=NC=CC=N3
• Uses: 2,2'-(1,4-Piperazinediyl)bis-pyrimidine is an impurity of Buspirone (B689850), an non-benzodiazepine anxiolytic; 5-hydroxytryptamine (5-HT1) receptor agonist. 2,2’-(1,4-Piperazinediyl)bis-pyrimidine is an impurity of Buspirone (B689850), an non-benzodiazepine anxiolytic; 5-hydroxytryptamine (5-HT1) receptor agonist.

Technology Process of 2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine

There total 2 articles about 2-[4-(Pyrimidin-2-yl)piperazin-1-yl]pyrimidine 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:

piperazine (110-85-0) + 2-chloropyrimidine (1722-12-9,1195939-87-7) → N-(2-pyridinyl)piperazine (20980-22-7) + 1,4-di-pyrimidin-2-yl-piperazine (84746-24-7)

Guidance literature:

With potassium carbonate; In water; at 50 - 65 ℃;

DOI:10.1021/jf100300a

Reference yield:

piperazine (110-85-0) + 2-chloropyrimidine (1722-12-9,1195939-87-7) → 1,4-di-pyrimidin-2-yl-piperazine (84746-24-7)

Guidance literature:

With sodium hydroxide; at 200 ℃;

upstream raw materials:

piperazine

2-chloropyrimidine

Refernces