4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide

Base Information

Chemical Name:4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide
CAS No.:64995-66-0
Molecular Formula:C12H14N4O
Molecular Weight:230.269
Hs Code.:
DSSTox Substance ID:DTXSID10553991
Wikidata:Q82434766

Synonyms:64995-66-0;4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide;DTXSID10553991

Suppliers and Price of 4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of 4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide

Chemical Property:

XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:230.11676108
Heavy Atom Count:17
Complexity:265

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=NC(=C1C(=O)N)NCC2=CC=CC=C2

Technology Process of 4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide

There total 2 articles about 4-(Benzylamino)-1-methyl-1H-imidazole-5-carboxamide 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: 3.0%

: 3-benzyl-7-methyladenine hydriodide

: 77868-58-7
6-benzylamino-7-methylpurine

: 64995-66-0
4-(N-benzylamino)-1-methyl-1H-imidazole-5-carboxamide

Guidance literature:: With sodium hydroxide; for 2h; Heating;

Reference yield:

: 64995-66-0
4-(N-benzylamino)-1-methyl-1H-imidazole-5-carboxamide

Guidance literature:: 1.Prep. Sulfonat VI, NaOH;

Reference yield:

: 64995-66-0
4-(N-benzylamino)-1-methyl-1H-imidazole-5-carboxamide

: 611-59-6
paraxanthine

Guidance literature:: Multi-step reaction with 4 steps

1: aq. AcOH-AcONa buffer, 10 percent aq. NaOH / ethyl acetate / 3.5 h / Ambient temperature; pH 5.2-5.3

2: 0.5 N aq. NaOH / 0.17 h / Heating

3: 1.) K₂CO₃ / 1.) DMF, 80 deg C, 1 h, 2.) room temperature, 3 h

4: 70 percent / H₂, 70percent aq. HClO₄ / 10percent Pd/C / acetic acid / 760 Torr / 1.) 40 deg C, 4 h, 2.) 60 deg C, 13 h

With sodium hydroxide; perchloric acid; AcOH-AcONa buffer; hydrogen; potassium carbonate; palladium on activated charcoal; In acetic acid; ethyl acetate;
DOI:10.1248/cpb.39.2855