2-(p-(Dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride

Base Information

• Chemical Name: 2-(p-(Dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride
• CAS No.: 2390-54-7
• Molecular Formula: C17H19ClN2S
• Molecular Weight: 318.87
• Hs Code.: PRICE
• Pharos Ligand ID: H4YRLLXB3ALZ
• Mol file: 2390-54-7.mol

Synonyms:2-(p-(dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride;thioflavin S;thioflavin T;thioflavine;ThT (dye)

Chemical Property of 2-(p-(Dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride

Chemical Property:

• Appearance/Colour: yellow to ochre-yellow powder
• Vapor Pressure: 0Pa at 25℃
• Melting Point: 212oC
• PSA: 35.36000
• Density: 1.301g/cm3 at 20℃
• LogP: 0.77120
• Storage Temp.: Store below +30°C.
• Solubility.: methanol: soluble1mg/mL
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 318.0957475
• Heavy Atom Count: 21
• Complexity: 331

Purity/Quality:

98% ^*data from raw suppliers

Basic Yellow 1 ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)[N+](=C(S2)C3=CC=C(C=C3)N(C)C)C.[Cl-]
• Uses: Textile dyeing, fluorescent sign paints, in combination with green or blue pigments to produce brilliant greens, phosphotungstic pigments. A dye used to visualize beta-amyloid plaques, like those associated with Alzheimer's Disease

Technology Process of 2-(p-(Dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride

There total 4 articles about 2-(p-(Dimethylamino)phenyl)-3,6-dimethylbenzothiazolium chloride 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:

methanol (67-56-1) + 2-(4-aminophenyl)-6-methyl-1,3-benzothiazole (92-36-4) → thioflavine T (2390-54-7)

Guidance literature:

With hydrogenchloride; at 150 - 200 ℃;

Reference yield:

N,N,N-trimethyl-4-(6-methyl-benzothiazol-2-yl)-anilinium; chloride (16862-65-0) → thioflavine T (2390-54-7)

Guidance literature:

Multi-step reaction with 2 steps

1: (heating)

2: (i) , (ii) ion-exchange resin

DOI:10.1021/jm00301a008

Reference yield:

N,N-dimethyl-4-(6-methylbenzo[d]thiazole-2-yl)aniline (10205-62-6) + methyl iodide (74-88-4) → thioflavine T (2390-54-7)

Guidance literature:

Multistep reaction; (i) , (ii) ion-exchange resin;

DOI:10.1021/jm00301a008

upstream raw materials:

methanol

2-(4-aminophenyl)-6-methyl-1,3-benzothiazole

N,N-dimethyl-4-(6-methylbenzo[d]thiazole-2-yl)aniline

methyl iodide

Downstream raw materials:

N,N-dimethyl-4-(6-methylbenzo[d]thiazole-2-yl)aniline

[2-(4-(dimethylamino)phenyl)-3,6-dimethylbenzo[d]thiazol-3-ium] iodide

Refernces

Design of β-amyloid aggregation inhibitors from a predicted structural motif

10.1021/jm201332p

The study focuses on the design of inhibitors for β-amyloid (Aβ) aggregation, a key process in Alzheimer's disease (AD). Researchers developed a substituted peptide, [Nle35, D-Pro37]Aβ42, using molecular dynamics simulations to stabilize Aβ structures suitable for NMR analysis. This peptide was found to stabilize Aβ trimers, prevent mature fibril and β-sheet formation, and reduce aggregation when mixed with wild-type Aβ42. Furthermore, a small molecule lead compound was identified through ligand-based drug design, showing similar inhibitory effects to the peptide. The study demonstrates the potential of using molecular dynamics simulation to guide experiments aimed at understanding AD and developing therapeutics.

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 2390-54-7 Thioflavine T

Send

Send

Metric Ton KG G Pound L ML

Send

Send