Bamipine

Base Information

• Chemical Name: Bamipine
• CAS No.: 4945-47-5
• Molecular Formula: C19H24 N2
• Molecular Weight: 280.413
• European Community (EC) Number: 225-587-2
• UNII: Y6BHZ28O92
• DSSTox Substance ID: DTXSID5057751
• Nikkaji Number: J8.788B
• Wikipedia: Bamipine
• Wikidata: Q4853502
• NCI Thesaurus Code: C76058
• Pharos Ligand ID: PVWXXTFBM1YW
• Metabolomics Workbench ID: 141934
• ChEMBL ID: CHEMBL520400
• Mol file: 4945-47-5.mol

Synonyms:bamipine;bamipine citrate;bamipine dihydrochloride;bamipine dihydrochloride, hydrate;bamipine ethanol hydrate;bamipine lactate;bamipine monohydrochloride;bampine hydrochloride;Soventol

Chemical Property of Bamipine

Chemical Property:

• Refractive Index: 1.8676 (estimate)
• Boiling Point: 412°Cat760mmHg
• PKA: pKa 3.34±0.04 (H2O t unde?ned I=0.30(NaCl)) (Uncertain);8.04±0.11(H2O t unde?ned I=0.30(NaCl)) (Uncertain)
• Flash Point: 184.6°C
• PSA: 6.48000
• Density: 1.071g/cm³
• LogP: 3.72530
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 280.193948774
• Heavy Atom Count: 21
• Complexity: 284

Purity/Quality:

98%Min ^*data from raw suppliers

Bamipine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC(CC1)N(CC2=CC=CC=C2)C3=CC=CC=C3
• Uses: Bamipine is an antihistamine that has anticholinergic properties. It is also a reagent for dopamine D3 receptor ligands based on scaffolds of biogenic amine GPCR (G protein-coupled receptor) ligands.

Technology Process of Bamipine

There total 2 articles about Bamipine 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:

N-(1-methyl-4-piperidinyl)aniline (22261-94-5) + benzyl chloride (100-44-7) → bamipine (4945-47-5)

Guidance literature:

With sodium amide; benzene;

Reference yield:

4-chloro-1-methylpiperidine (5570-77-4) + N-Benzylaniline (758640-21-0,103-32-2) → bamipine (4945-47-5)

Guidance literature:

With sodium amide; xylene;

Reference yield:

bamipine (4945-47-5) + chloroformic acid ethyl ester (541-41-3) → C21H26N2O2

Guidance literature:

In toluene; for 5h; Heating;

DOI:10.1016/j.bmc.2007.08.034

upstream raw materials:

4-chloro-1-methylpiperidine

N-Benzylaniline

N-(1-methyl-4-piperidinyl)aniline

benzyl chloride