Givinostat

Base Information

• Chemical Name: Givinostat
• CAS No.: 497833-27-9
• Molecular Formula: C24H27N3O4
• Molecular Weight: 421.496
• European Community (EC) Number: 823-729-3
• UNII: 5P60F84FBH
• DSSTox Substance ID: DTXSID70198049
• Nikkaji Number: J2.554.201K
• Wikipedia: Givinostat
• Wikidata: Q426257
• NCI Thesaurus Code: C71716
• Pharos Ligand ID: LXP6Q5RN575Q
• Metabolomics Workbench ID: 153595
• ChEMBL ID: CHEMBL1213492
• Mol file: 497833-27-9.mol

Synonyms:givinostat

Chemical Property of Givinostat

Chemical Property:

• PKA: 8.97±0.10(Predicted)
• PSA: 90.90000
• Density: 1.26 g/cm³
• LogP: 5.01320
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 421.20015635
• Heavy Atom Count: 31
• Complexity: 575

Purity/Quality:

99% ^*data from raw suppliers

Givinostat 98+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC1=CC2=C(C=C1)C=C(C=C2)COC(=O)NC3=CC=C(C=C3)C(=O)NO
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• Recent EU Clinical Trials: A randomised, double-blind, placebo-controlled study to evaluate the micro-macroscopic effects on muscles, the safety and tolerability, and the efficacy of

Technology Process of Givinostat

There total 1 articles about Givinostat 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:

C24H25ClN2O3 → Givinostat (497833-27-9)

Guidance literature:

With hydroxylamine; In tetrahydrofuran; water; at 12 - 23 ℃; Temperature; Inert atmosphere;

Reference yield:

Givinostat (497833-27-9) + (2-chloro-4-nitrophenyl)-β-D-glucopyranoside (120221-14-9,119047-14-2) → C30H37N3O9

Guidance literature:

With UDP; magnesium chloride; In aq. buffer; at 30 ℃; pH=8; Enzymatic reaction;

DOI:10.1002/cbic.201900601

Refernces