Lubeluzole

Base Information

Chemical Name:Lubeluzole
CAS No.:144665-07-6
Molecular Formula:C₂₂H₂₅F₂N₃O₂S
Molecular Weight:433.522
Hs Code.:
European Community (EC) Number:806-348-7
UNII:V2SIB71583
DSSTox Substance ID:DTXSID60162779
Nikkaji Number:J615.844G
Wikipedia:Lubeluzole
Wikidata:Q6695177
NCI Thesaurus Code:C170134
ChEMBL ID:CHEMBL281724
Mol file:144665-07-6.mol

Synonyms:lubeluzole;R-91154

Suppliers and Price of Lubeluzole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
Lubeluzole dihydrochloride ≥98% (HPLC)
25mg
$ 492.00

Sigma-Aldrich
Lubeluzole dihydrochloride ≥98% (HPLC)
5mg
$ 123.00

American Custom Chemicals Corporation
(+)-(S)-1-[4-[N-(BENZOTHIAZOL-2-YL)-N-METHYLAMINO]PIPERIDIN-1-YL]-3-(3,4-DIFLUOROPHENOXY)-2-PROPANOL 95.00%
5MG
$ 495.06

Total 2 raw suppliers

Chemical Property of Lubeluzole

Chemical Property:

Vapor Pressure:2.75E-14mmHg at 25°C
Melting Point:65.8°
Boiling Point:579.8°Cat760mmHg
Flash Point:304.5°C
PSA：77.07000
Density:1.327g/cm³
LogP:3.85290
Storage Temp.:2-8°C
Solubility.:H2O: soluble2mg/mL, clear (warmed)
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:433.16355455
Heavy Atom Count:30
Complexity:541

Purity/Quality:

97% ^*data from raw suppliers

Lubeluzole dihydrochloride ≥98% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C1CCN(CC1)CC(COC2=CC(=C(C=C2)F)F)O)C3=NC4=CC=CC=C4S3
Isomeric SMILES:CN(C1CCN(CC1)C[C@@H](COC2=CC(=C(C=C2)F)F)O)C3=NC4=CC=CC=C4S3

Technology Process of Lubeluzole

There total 25 articles about Lubeluzole 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: 84.0%