6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Base Information

Chemical Name:6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
CAS No.:896854-73-2
Molecular Formula:C₁₉H₂₂N₂O₃S
Molecular Weight:358.461
Hs Code.:
DSSTox Substance ID:DTXSID601325792
ChEMBL ID:CHEMBL1326429

Synonyms:MLS000763175;CHEMBL1326429;DTXSID601325792;HMS2787A15;STK582076;AKOS005505784;6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide;896854-73-2;SMR000439605;6,7-Dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbothioic acid (4-methoxy-phenyl)-amide;6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide

Suppliers and Price of 6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Supply Marketing:

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

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Chemical Property of 6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:358.13511374
Heavy Atom Count:25
Complexity:442

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC=C(C=C1)NC(=S)N2CCC3=CC(=C(C=C3C2)OC)OC

Technology Process of 6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

There total 4 articles about 6,7-dimethoxy-N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide 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: 58.7%

: 1745-07-9
6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

: 2284-20-0
4-Methoxyphenyl isothiocyanate

: 896854-73-2
C₁₉H₂₂N₂O₃S

Guidance literature:: Reflux;
DOI:10.2174/157018010790945797

Reference yield:

: 104-94-9
4-methoxy-aniline

: 896854-73-2
C₁₉H₂₂N₂O₃S

Guidance literature:: Multi-step reaction with 3 steps

1: 6 h / 35 - 40 °C

2: methyl chloroformate / chloroform / 5 h / 0 °C

3: Reflux

With methyl chloroformate; In chloroform;
DOI:10.2174/157018010790945797

Reference yield:

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: 896854-73-2
C₁₉H₂₂N₂O₃S

Guidance literature:: Multi-step reaction with 2 steps

1.1: hydrogenchloride / ethanol; water / 100 °C

1.2: pH 9

2.1: Reflux

With hydrogenchloride; In ethanol; water; 1.1: Pictet-Spengler cyclisation;
DOI:10.2174/157018010790945797