Indoramin

Base Information

• Chemical Name: Indoramin
• CAS No.: 26844-12-2
• Molecular Formula: C22H25 N3 O
• Molecular Weight: 347.46
• Hs Code.: 2933990090
• European Community (EC) Number: 248-041-5
• UNII: 0Z802HMY7H
• DSSTox Substance ID: DTXSID7048370
• Nikkaji Number: J10.427B
• Wikipedia: Indoramin
• Wikidata: Q408963
• NCI Thesaurus Code: C65916
• Pharos Ligand ID: MF8UW4CFP8G6
• Metabolomics Workbench ID: 144183
• ChEMBL ID: CHEMBL279516
• Mol file: 26844-12-2.mol

Synonyms:Indoramin;Wy 21901;Wy-21901;Wy21901

Chemical Property of Indoramin

Chemical Property:

• Vapor Pressure: 2.36E-14mmHg at 25°C
• Melting Point: 208-210°
• Boiling Point: 600°Cat760mmHg
• PKA: 14.32±0.20(Predicted)
• Flash Point: 316.7°C
• PSA: 48.13000
• Density: 1.21g/cm³
• LogP: 3.93360
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 347.199762429
• Heavy Atom Count: 26
• Complexity: 454

Purity/Quality:

99% ^*data from raw suppliers

INDORAMIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCC1NC(=O)C2=CC=CC=C2)CCC3=CNC4=CC=CC=C43
• Uses: Antihypertensive.
• Therapeutic Function: Antihypertensive

Technology Process of Indoramin

There total 3 articles about Indoramin 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: 82.0%

4-benzamido-1-[2-(3-indolyl)ethyl]-pyridinium bromide → 3-[2-(4-benzamido-1-piperidyl)ethyl]indole (26844-12-2)

Guidance literature:

With sodium borohydrid; In isopropyl alcohol;

Reference yield:

2-(4-benzoylamino-piperidin-1-yl)-1-indol-3-yl-ethanone (26844-47-3) → 2-(4-benzoylamino-piperidin-1-yl)-1-indol-3-yl-ethanol (35631-16-4) + 3-[2-(4-benzamido-1-piperidyl)ethyl]indole (26844-12-2)

Guidance literature:

With sodium borohydrid; In N-methyl-acetamide; water; isopropyl alcohol;

Reference yield:

→ 3-[2-(4-benzamido-1-piperidyl)ethyl]indole (26844-12-2)

Guidance literature:

3-<2-(4-Aminopiperid-1-yl)-ethyl>-indol 25, Benzoylchlorid;

DOI:10.1021/jm00293a009

upstream raw materials:

2-(4-benzoylamino-piperidin-1-yl)-1-indol-3-yl-ethanone

Refernces

• 1、 -. "ANTIHYPERTENSIVE THERAPY". . . Retrieved 2009/09/08.
• 2、 -. "Process for preparing 3-[(benzamidopiperid-1-yl)alkyl] indoles". . . Retrieved 2008/06/13.