2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide

Base Information

Chemical Name:2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide
CAS No.:917596-87-3
Molecular Formula:C₁₉H₁₇BrN₂O₃
Molecular Weight:401.26
Hs Code.:
DSSTox Substance ID:DTXSID60582251
Nikkaji Number:J2.385.902E
Wikidata:Q82473614

Synonyms:917596-87-3;2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide;DTXSID60582251

Suppliers and Price of 2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide

Supply Marketing:

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

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Chemical Property of 2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:400.04225
Heavy Atom Count:25
Complexity:464

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C1=CC=CC2=C1C=CN=C2)C(=O)C3=CC(=C(C=C3Br)OC)OC

Technology Process of 2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide

There total 4 articles about 2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxy-N-methylbenzamide 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: 71.0%

: 917596-84-0
2-bromo-N-(isoquinol-5-yl)-4,5-dimethoxybenzamide

: 74-88-4
methyl iodide

: 917596-87-3
2-bromo-N-methyl-N-(isoquinol-5-yl)-4,5-dimethoxybenzamide

Guidance literature:: 2-bromo-N-(isoquinol-5-yl)-4,5-dimethoxybenzamide; With sodium hydride; In N,N-dimethyl-formamide;

methyl iodide; In N,N-dimethyl-formamide; for 1h;
DOI:10.1002/jhet.5570430518

Reference yield:

: 6286-46-0
2-bromo-4,5-dimethoxybenzoic acid

: 917596-87-3
2-bromo-N-methyl-N-(isoquinol-5-yl)-4,5-dimethoxybenzamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: 20 percent / EDCI; 4-DMAP / CH₂Cl₂ / 24 h / 20 °C

2.1: NaH / dimethylformamide

2.2: 71 percent / dimethylformamide / 1 h

With dmap; sodium hydride; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1002/jhet.5570430518

Reference yield:

: 1125-60-6
isoquinolin-5-ylamine

: 917596-87-3
2-bromo-N-methyl-N-(isoquinol-5-yl)-4,5-dimethoxybenzamide

Guidance literature:: Multi-step reaction with 2 steps

1.1: 20 percent / EDCI; 4-DMAP / CH₂Cl₂ / 24 h / 20 °C

2.1: NaH / dimethylformamide

2.2: 71 percent / dimethylformamide / 1 h

With dmap; sodium hydride; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1002/jhet.5570430518