(3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide

Base Information

Chemical Name:(3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide
CAS No.:404001-44-1
Molecular Formula:C₁₇H₁₈N₂O₂
Molecular Weight:282.342
Hs Code.:
DSSTox Substance ID:DTXSID801161447

Synonyms:DTXSID801161447;AKOS014304857;(3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide;404001-44-1

Suppliers and Price of (3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide

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 (3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:282.136827821
Heavy Atom Count:21
Complexity:342

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1C(NCC2=CC=CC=C21)C(=O)NOCC3=CC=CC=C3
Isomeric SMILES:C1[C@@H](NCC2=CC=CC=C21)C(=O)NOCC3=CC=CC=C3

Technology Process of (3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide

There total 3 articles about (3R)-1,2,3,4-Tetrahydro-N-(phenylmethoxy)-3-isoquinolinecarboxamide 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:

: 362477-34-7
(3R)-N-benzyloxy-2-tert-butoxycarbonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

: 404001-44-1
(3R)-N-benzyloxy-1,2,3,4-tetrahydroisoquinoline-3-hydroxamide

Guidance literature:: With hydrogenchloride; In ethyl acetate; at 20 ℃; for 2h;
DOI:10.1021/jm0103211

Reference yield:

: 78879-20-6,144069-68-1,115962-35-1
D-N-tert-butoxycarbonyl-1,2,3,4-tetrahydroisoquinolinoline-3-carboxylic acid

: 404001-44-1
(3R)-N-benzyloxy-1,2,3,4-tetrahydroisoquinoline-3-hydroxamide

Guidance literature:: Multi-step reaction with 2 steps

1: 41 percent / WSC; HOBt; triethylamine / dimethylformamide / 20 °C

2: 4.6 g / 4N HCl / ethyl acetate / 2 h / 20 °C

With hydrogenchloride; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; triethylamine; In ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm0103211

Reference yield:

: 41220-48-8
(3R)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid hydrochloride

: 404001-44-1
(3R)-N-benzyloxy-1,2,3,4-tetrahydroisoquinoline-3-hydroxamide

Guidance literature:: Multi-step reaction with 3 steps

1: 61 percent / aq. sodium carbonate / dioxane / 20 °C

2: 41 percent / WSC; HOBt; triethylamine / dimethylformamide / 20 °C

3: 4.6 g / 4N HCl / ethyl acetate / 2 h / 20 °C

With hydrogenchloride; sodium carbonate; benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; triethylamine; In 1,4-dioxane; ethyl acetate; N,N-dimethyl-formamide;
DOI:10.1021/jm0103211