Enecadin hydrochloride

Base Information

• Chemical Name: Enecadin hydrochloride
• CAS No.: 178429-67-9
• Molecular Formula: C₂₁H₂₈FN₃O*ClH
• Molecular Weight: 393.932
• European Community (EC) Number: 639-445-6
• UNII: D9H26GER62
• Wikidata: Q27276279
• ChEMBL ID: CHEMBL2401778
• Mol file: 178429-67-9.mol

Synonyms:4-(4-fluorophenyl)-2-methyl-6-(5-piperidinopentyloxy)pyrimidine hydrochloride;NS 7;NS-7

Chemical Property of Enecadin hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 393.1983184
• Heavy Atom Count: 27
• Complexity: 384

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CC(=N1)OCCCCCN2CCCCC2)C3=CC=C(C=C3)F.Cl
• Recent EU Clinical Trials: TOLERABILITY OF ENECADIN (INN) IN ACUTE ISCHEMIC STROKE TRIAL - TEST- PHASE IIA : A multicentre, double-blind, randomised, placebo-controlled, dose-escalating parallel- group study to investigate the tolerability of enecadin (INN) in acute ischemic stroke

Technology Process of Enecadin hydrochloride

There total 2 articles about Enecadin hydrochloride 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: 91.0%

→ 4-(4-fluorophenyl)-2-methyl-6-(5-piperidinopentyloxy)pyrimidine hydrochloride (178429-67-9)

Guidance literature:

Reference yield:

5-(1-piperidyl)-1-pentanol (2937-83-9) + 4-chloro-6-(4-fluorophenyl)-2-methylpyrimidine (178430-13-2) → 4-(4-fluorophenyl)-2-methyl-6-(5-piperidinopentyloxy)pyrimidine hydrochloride (178429-67-9)

Guidance literature:

In tetrahydrofuran; methanol; N,N-dimethyl-formamide;

upstream raw materials:

5-(1-piperidyl)-1-pentanol

4-chloro-6-(4-fluorophenyl)-2-methylpyrimidine