N-[2-(1H-indol-3-yl)ethyl]docosanamide

Base Information

• Chemical Name: N-[2-(1H-indol-3-yl)ethyl]docosanamide
• CAS No.: 7367-79-5
• Molecular Formula: C₃₂H₅₄N₂O
• Molecular Weight: 482.794
• Nikkaji Number: J1.125.817D
• Wikidata: Q105025104
• Metabolomics Workbench ID: 48391
• ChEMBL ID: CHEMBL490312
• Mol file: 7367-79-5.mol

Synonyms:N-behenoyltryptamine;N-[2-(1H-indol-3-yl)ethyl]docosanamide;Behenic acid tryptamide;7367-79-5;Nb-Behenoyltryptamine;Nb-Docosanoyltryptamine;CHEMBL490312;SCHEMBL3806536;CHEBI:166545;3-[2-(Docosanoylaminoethyl)]indole

Chemical Property of N-[2-(1H-indol-3-yl)ethyl]docosanamide

Chemical Property:

• Melting Point: 116-120oC
• PSA: 48.38000
• LogP: 10.48880
• XLogP3: 12.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 23
• Exact Mass: 482.423614350
• Heavy Atom Count: 35
• Complexity: 494

Purity/Quality:

98%Min ^*data from raw suppliers

Docosanoic acid tryptamide analyticalstandard ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC1=CNC2=CC=CC=C21

Technology Process of N-[2-(1H-indol-3-yl)ethyl]docosanamide

There total 1 articles about N-[2-(1H-indol-3-yl)ethyl]docosanamide 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: 92.0%

tryptamine (61-54-1) + docosanoic acid anhydride (55726-23-3) → N-behenoyltryptamine (7367-79-5)

Guidance literature:

DOI:10.3987/COM-98-8156

upstream raw materials:

tryptamine

docosanoic acid anhydride

Refernces