7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo-

Base Information

• Chemical Name: 7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo-
• CAS No.: 131927-04-3
• Molecular Formula: C25H26 Cl N5 O4
• Molecular Weight: 495.958
• DSSTox Substance ID: DTXSID40927404

Synonyms:BRN 3640027;131927-04-3;7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo-;C25H26ClN5O4;DTXSID40927404;LS-127140;N-[2-(4-Chlorophenoxy)-1-phenylpropyl]-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propanimidic acid

Chemical Property of 7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.35g/cm³
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 495.1673320
• Heavy Atom Count: 35
• Complexity: 771

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(C1=CC=CC=C1)NC(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C)OC4=CC=C(C=C4)Cl

Technology Process of 7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo-

There total 1 articles about 7H-Purine-7-propanamide, 1,2,3,6-tetrahydro-N-(2-(4-chlorophenoxy)-1-phenylpropyl)-1,3-dimethyl-2,6-dioxo- 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: 85.0%

3-(1,3-Dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-propionyl chloride + 2-(4-Chloro-phenoxy)-1-phenyl-propylamine; hydrochloride (126104-50-5) → N-[2-(4-Chloro-phenoxy)-1-phenyl-propyl]-3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-propionamide (131927-04-3)

Guidance literature:

With triethylamine; In 1,4-dioxane; for 48h; Ambient temperature;

upstream raw materials:

2-(4-Chloro-phenoxy)-1-phenyl-propylamine; hydrochloride

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