2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxybenzamide

Base Information

Chemical Name:2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxybenzamide
CAS No.:917596-84-0
Molecular Formula:C18H15BrN2O3
Molecular Weight:387.233
Hs Code.:
DSSTox Substance ID:DTXSID40582178
Nikkaji Number:J2.385.901G
Wikidata:Q82473514

Synonyms:917596-84-0;2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxybenzamide;DTXSID40582178

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

Supply Marketing:

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

Manufacturers and distributors:

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

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:386.02660
Heavy Atom Count:24
Complexity:437

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C(C(=C1)C(=O)NC2=CC=CC3=C2C=CN=C3)Br)OC

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

There total 3 articles about 2-Bromo-N-(isoquinolin-5-yl)-4,5-dimethoxybenzamide 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: 27.0%

: 1125-60-6
isoquinolin-5-ylamine

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

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

: bis(2-bromo-4,5-dimethoxybenzoyl)(isoquinolin-5-yl)azane

Guidance literature:: With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃; for 24h;
DOI:10.1002/jhet.5570430518

Reference yield:

: 1125-60-6
isoquinolin-5-ylamine

: 55171-61-4
2-bromo-4,5-dimethoxybenzoyl chloride

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

Guidance literature:: With dmap; In dichloromethane; at 20 ℃; for 12h;
DOI:10.1002/jhet.5570430518

Reference yield:

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

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

Guidance literature:: Multi-step reaction with 2 steps

1: thionyl chloride / CH₂Cl₂ / 2 h / Heating

2: 4-DMAP / CH₂Cl₂ / 12 h / 20 °C

With dmap; thionyl chloride; In dichloromethane;
DOI:10.1002/jhet.5570430518