1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate

Base Information

• Chemical Name: 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate
• CAS No.: 58090-40-7
• Molecular Formula: C₁₈H₂₀N₆O₄
• Molecular Weight: 384.395
• Wikidata: Q76151095

Synonyms:1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate;beta-D-Ribofuranuronamide, 1-(6-amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-, trihydrate (1:3);58090-40-7;C18H20N6O4.3H2O;C18-H20-N6-O4.3H2-O;LS-143762

Chemical Property of 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate

Chemical Property:

• Density: 1.66g/cm³
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 384.15460314
• Heavy Atom Count: 28
• Complexity: 572

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)NC(=O)C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)O
• Isomeric SMILES: CC1=C(C(=CC=C1)C)NC(=O)[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O

Technology Process of 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate

There total 2 articles about 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-(2,6-dimethylphenyl)-beta-D-ribofuranuronamide trihydrate 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:

adenosine 5'-(N-methyl)carbonyl chloride (41110-75-2) + 2,6-dimethylaniline (87-62-7) → 1-(6-amino-purin-9-yl)-β-D-1-deoxy-ribofuranuronic acid 2,6-dimethyl-anilide (58090-40-7)

Guidance literature:

In chloroform; for 2h; Ambient temperature;

DOI:10.1021/jm00177a021

Reference yield:

→ 1-(6-amino-purin-9-yl)-β-D-1-deoxy-ribofuranuronic acid 2,6-dimethyl-anilide (58090-40-7)

Guidance literature:

entspr.Acetonid;

upstream raw materials:

adenosine 5'-(N-methyl)carbonyl chloride

2,6-dimethylaniline

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