5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide

Base Information

• Chemical Name: 5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide
• CAS No.: 6198-24-9
• Molecular Formula: C₂₈H₃₄O₁₆
• Molecular Weight: 626.568
• DSSTox Substance ID: DTXSID70362223
• Wikidata: Q82145094

Synonyms:STK025251;5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide;6198-24-9;DTXSID70362223;AKOS001950551;5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]benzamide

Chemical Property of 5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide

Chemical Property:

• Density: 1.54g/cm³
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 470.01452
• Heavy Atom Count: 29
• Complexity: 577

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=NN(N=C2C=C1NC(=O)C3=C(C=CC(=C3)Br)Cl)C4=CC=C(C=C4)OC

Technology Process of 5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide

There total 1 articles about 5-bromo-2-chloro-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]benzamide 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:

isovanillin (621-59-0) + 1-[2-hydroxy-4,6-bis-(tetra-O-acetyl-β-D-glucopyranosyloxy)-phenyl]-ethanone (6157-13-7) → 2',4'-bis-β-D-glucopyranosyloxy-3,6'-dihydroxy-4-methoxy-trans-chalcone (6198-24-9,88155-75-3)

Guidance literature:

With potassium hydroxide;

Reference yield:

2',4'-bis-β-D-glucopyranosyloxy-3,6'-dihydroxy-4-methoxy-trans-chalcone (6198-24-9,88155-75-3) → (S)-2,3-dihydro-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-benzopyrone (520-33-2,41001-90-5,69097-99-0)

Guidance literature:

With sulfuric acid;

Reference yield:

2',4'-bis-β-D-glucopyranosyloxy-3,6'-dihydroxy-4-methoxy-trans-chalcone (6198-24-9,88155-75-3) → 1-(2,4-bis-β-D-glucopyranosyloxy-6-hydroxy-phenyl)-3-(3-hydroxy-4-methoxy-phenyl)-propan-1-one (25242-99-3)

Guidance literature:

With palladium on activated charcoal; ethanol; Hydrogenation;

upstream raw materials:

isovanillin

1-[2-hydroxy-4,6-bis-(tetra-O-acetyl-β-D-glucopyranosyloxy)-phenyl]-ethanone

Downstream raw materials:

1-(2,4-bis-β-D-glucopyranosyloxy-6-hydroxy-phenyl)-3-(3-hydroxy-4-methoxy-phenyl)-propan-1-one

(Ξ)-5,7-bis-β-D-glucopyranosyloxy-2-(3-hydroxy-4-methoxy-phenyl)-chroman-4-one

(S)-2,3-dihydro-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-benzopyrone

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