N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide

Base Information

• Chemical Name: N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide
• CAS No.: 1020719-20-3
• Molecular Formula: C₂₆H₂₅NO₃
• Molecular Weight: 404.45
• Mol file: 1020719-20-3.mol

Synonyms:N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide;4-Methyl-3-oxo-N-[4-(phenylMethoxy)phenyl]-2-(phenyl-2,3,4,5,6-d5-Methylene)pentanaMiMde;4-Methyl-3-oxo-N-[4-(phenylmethoxy)phenyl]-2-(phenyl-2,3,4,5,6-d5-methylene)pentanamide

Chemical Property of N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide

Chemical Property:

• PSA: 55.40000
• LogP: 5.58580
• Solubility.: Acetone, Chloroform, Dichloromethane, Ethyl Acetate

Purity/Quality:

97% ^*data from raw suppliers

N-4-Benzyloxyphenylα-Benzilidene-d5Isobutyrylacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Uses: A deuterated intermediate of the metabolite of Atorvastin, a selective, competitive HMG-CoA reductase inhibitor. Atorvastin is the only drug in its class specfically indicated for lowering both elevated LDL-cholesterol and triglycerides in patients with hypercholesterolemia.

Technology Process of N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide

There total 3 articles about N-4-Benzyloxyphenyl α-Benzilidene-d5 Isobutyrylacetamide 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:

p-benzyloxyaniline (6373-46-2) → C26H20(2)H5NO3 (1020719-20-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 82 percent / toluene / Heating

2: β-alanine; glacial acetic acid / hexane / Heating

With acetic acid; 3-amino propanoic acid; In hexane; toluene; 1: Acylation / 2: Condensation;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

Reference yield:

isobutyryl Meldrum's acid → C26H20(2)H5NO3 (1020719-20-3)

Guidance literature:

Multi-step reaction with 2 steps

1: 82 percent / toluene / Heating

2: β-alanine; glacial acetic acid / hexane / Heating

With acetic acid; 3-amino propanoic acid; In hexane; toluene; 1: Acylation / 2: Condensation;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

Reference yield:

2,3,4,5,6-pentadeuteriobenzaldehyde (14132-51-5) + N-(4-(benzyloxy)phenyl)-4-methyl-3-oxopentanamide (265989-30-8) → C26H20(2)H5NO3 (1020719-20-3)

Guidance literature:

With acetic acid; 3-amino propanoic acid; In hexane; Heating;

DOI:10.1002/(SICI)1099-1344(20000315)43:3<261::AID-JLCR312>3.0.CO;2-T

upstream raw materials:

2,3,4,5,6-pentadeuteriobenzaldehyde

N-(4-(benzyloxy)phenyl)-4-methyl-3-oxopentanamide

p-benzyloxyaniline

Downstream raw materials:

C₃₃H₂₅⁽²⁾H₅FNO₄

C₄₇H₄₈⁽²⁾H₅FN₂O₆

C₄₀H₄₂⁽²⁾H₅FN₂O₆

C₃₃H₂₈⁽²⁾H₅FN₂O₅