Ethyl carfluzepate

Base Information

• Chemical Name: Ethyl carfluzepate
• CAS No.: 65400-85-3
• Molecular Formula: C₂₀H₁₇ClFN₃O₄
• Molecular Weight: 417.824
• UNII: 36M73UIK01
• DSSTox Substance ID: DTXSID50867140
• Nikkaji Number: J19.857I
• Wikipedia: Ethyl_carfluzepate
• Wikidata: Q5404448
• NCI Thesaurus Code: C65563
• ChEMBL ID: CHEMBL2106564
• Mol file: 65400-85-3.mol

Synonyms:Ethyl carfluzepate;65400-85-3;Ethyl carfluzepate [INN];Ethylis carfluzepas;Carfluzepate d'ethyle;Carfluzepato de etilo;Ethylis carfluzepas [INN-Latin];Carfluzepate d'ethyle [INN-French];Carfluzepato de etilo [INN-Spanish];CM 7120;UNII-36M73UIK01;36M73UIK01;Ethyl 7-chloro-5-(o-fluorophenyl)-2,3-dihydro-1-(methylcarbamoyl)-2-oxo-1H-1,4-benzodiazepine-3-carboxylate;C20H17ClFN3O4;1H-1,4-Benzodiazepine-3-carboxylic acid, 2,3-dihydro-7-chloro-5-(2-fluorophenyl)-1-((methylamino)carbonyl)-2-oxo-, ethyl ester;1H-1,4-Benzodiazepine-3-carboxylic acid,7-chloro-5-(2-fluorophenyl)-2,3-dihydro-1-[(methylamino)carbonyl]-2-oxo-, ethyl ester;SCHEMBL1003754;CHEMBL2106564;DTXSID50867140;C20-H17-Cl-F-N3-O4;CM-7120;LS-34026;Q5404448

Chemical Property of Ethyl carfluzepate

Chemical Property:

• PSA: 91.56000
• Density: 1.4g/cm³
• LogP: 2.63920
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 417.0891619
• Heavy Atom Count: 29
• Complexity: 689

Purity/Quality:

99% ^*data from raw suppliers

ETHYL CARFLUZEPATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3F)C(=O)NC

Technology Process of Ethyl carfluzepate

There total 1 articles about Ethyl carfluzepate 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:

→ 7-chloro-5-(2-fluoro-phenyl)-1-methylcarbamoyl-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepine-3-carboxylic acid ethyl ester (65400-85-3)

Guidance literature:

7-Chlor-3-ethoxycarbonyl-5-(2-fluorphenyl)-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin, p-TosOH, Methylisocyanat, Δ;