Glenvastatin

Base Information

• Chemical Name: Glenvastatin
• CAS No.: 122254-45-9
• Molecular Formula: C₂₇H₂₆FNO₃
• Molecular Weight: 431.507
• UNII: X98U22RT62
• ChEMBL ID: CHEMBL2368199
• DSSTox Substance ID: DTXSID601009445
• Metabolomics Workbench ID: 70502
• NCI Thesaurus Code: C73064
• Nikkaji Number: J271.491D
• Pharos Ligand ID: 45SH4F3DUD77
• Wikidata: Q27106818
• Mol file: 122254-45-9.mol

Synonyms:HR 780;HR-780

Chemical Property of Glenvastatin

Chemical Property:

• Vapor Pressure: 4.46E-16mmHg at 25°C
• Boiling Point: 616.9°Cat760mmHg
• Flash Point: 326.9°C
• PSA: 59.42000
• Density: 1.242g/cm³
• LogP: 5.75780
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 431.18967185
• Heavy Atom Count: 32
• Complexity: 639

Purity/Quality:

99% ^*data from raw suppliers

GLENVASTATIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)F)C=CC4CC(CC(=O)O4)O
• Isomeric SMILES: CC(C)C1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)F)/C=C/[C@@H]4C[C@H](CC(=O)O4)O

Technology Process of Glenvastatin

There total 2 articles about Glenvastatin 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:

(4R,6S)-4-(tert-Butyl-diphenyl-silanyloxy)-6-{(E)-2-[4-(4-fluoro-phenyl)-2-isopropyl-6-phenyl-pyridin-3-yl]-vinyl}-tetrahydro-pyran-2-one (122254-10-8) → glenvastatin (122621-62-9,122254-45-9)

Guidance literature:

With tetrabutyl ammonium fluoride; acetic acid; In tetrahydrofuran; for 15h; Yield given; Ambient temperature;

DOI:10.1021/jm00163a010

Reference yield:

→ glenvastatin (122621-62-9,122254-45-9)

Guidance literature:

Reference yield: 91.0%

glenvastatin (122621-62-9,122254-45-9) → 6(R)-<2-<4-(4-fluorophenyl)-2-(1-methylethyl)-6-phenylpyridin-3-yl>ethyl>-4(R)-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-one (122254-73-3)

Guidance literature:

With hydrogen; triethylamine; palladium on activated charcoal; In methanol; ethyl acetate;

DOI:10.1021/jm00163a010

upstream raw materials:

(4R,6S)-4-(tert-Butyl-diphenyl-silanyloxy)-6-{(E)-2-[4-(4-fluoro-phenyl)-2-isopropyl-6-phenyl-pyridin-3-yl]-vinyl}-tetrahydro-pyran-2-one

Downstream raw materials:

6(R)-<2-<4-(4-fluorophenyl)-2-(1-methylethyl)-6-phenylpyridin-3-yl>ethyl>-4(R)-hydroxy-3,4,5,6-tetrahydro-2H-pyran-2-one