Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester

Base Information

• Chemical Name: Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester
• CAS No.: 1228996-85-7
• Molecular Formula: C₂₁H₂₈N₂O₆S
• Molecular Weight: 436.529
• DSSTox Substance ID: DTXSID301125602
• Nikkaji Number: J2.836.612D
• ChEMBL ID: CHEMBL3622045

Synonyms:CHEMBL3622045;DTXSID301125602;7-Ethyl-1,2,3,4-tetrahydro-2-[(3,4,5-trimethoxyphenyl)methyl]-6-isoquinolinyl sulfamate;7-ethyl-6-sulfamoyloxy-2-(3,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline;1228996-85-7;Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester

Chemical Property of Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 436.16680779
• Heavy Atom Count: 30
• Complexity: 628

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1=C(C=C2CCN(CC2=C1)CC3=CC(=C(C(=C3)OC)OC)OC)OS(=O)(=O)N

Technology Process of Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester

There total 1 articles about Sulfamic acid 2-(3,4,5-trimethoxybenzyl)-7-ethyl-1,2,3,4-tetrahydroisoquinoline-6-yl ester 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:

C21H27NO4 (1228996-84-6) → 7-ethyl-6-sulfamoyloxy-2-(3′,4′,5′-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinoline (1228996-85-7)

Guidance literature:

C₂₁H₂₇NO₄; With sulphamoyl chloride; In 2,4-dichlorophenoxyacetic acid dimethylamine; at 20 ℃; for 24h; Inert atmosphere;

With potassium hydrogencarbonate; In water; 2,4-dichlorophenoxyacetic acid dimethylamine;

DOI:10.1039/c002558e

upstream raw materials:

C₂₁H₂₇NO₄

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