Buspirone n-oxide

Base Information

• Chemical Name: Buspirone n-oxide
• CAS No.: 220747-81-9
• Molecular Formula: C₂₁H₃₁N₅O₃
• Molecular Weight: 401.509
• UNII: 5Y5KFQ9MG8
• ChEMBL ID: CHEMBL3544620
• Nikkaji Number: J3.006.303A
• Mol file: 220747-81-9.mol

Synonyms:buspirone n-oxide;220747-81-9;5Y5KFQ9MG8;UNII-5Y5KFQ9MG8;8-(4-(1-Oxido-4-(2-pyrimidinyl)-1-piperazinyl)butyl)-8-azaspiro(4.5)decane-7,9-dione;8-[4-(1-oxido-4-pyrimidin-2-ylpiperazin-1-ium-1-yl)butyl]-8-azaspiro[4.5]decane-7,9-dione;8-Azaspiro(4.5)decane-7,9-dione, 8-(4-(1-oxido-4-(2-pyrimidinyl)-1-piperazinyl)butyl)-;8-[4-[1-Oxido-4-(2-pyrimidinyl)-1-piperazinyl]butyl]-8-azaspiro[4.5]decane-7,9-dione;CHEMBL3544620

Chemical Property of Buspirone n-oxide

Chemical Property:

• Melting Point: 101-106°C
• Storage Temp.: Refrigerator, Under Inert Atmosphere
• Solubility.: DMSO (Slightly, Heated), Methanol (Very Slightly)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 401.24268987
• Heavy Atom Count: 29
• Complexity: 573

Purity/Quality:

> 95% ^*data from raw suppliers

BuspironeN-Oxide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2(C1)CC(=O)N(C(=O)C2)CCCC[N+]3(CCN(CC3)C4=NC=CC=N4)[O-]
• Uses: Buspirone N-Oxide is a metabolite of Buspirone (B689850), a 5-hydroxytryptamine (5-HT1) receptor agonist.

Technology Process of Buspirone n-oxide

There total 1 articles about Buspirone n-oxide 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:

BUSPIRONE (36505-84-7) → Buspirone N-oxide (220747-81-9)

Guidance literature:

With Davis' N-sulfonyloxaziridine; In dichloromethane; at 25 ℃; for 1h; Yield given;

DOI:10.1080/00304949609355915

upstream raw materials:

BUSPIRONE

Refernces