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2-(4′-(dimethylamino)phenyl)-6-methyl-benzothiazole , CAS No.10205-62-6

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Item Number
D335342
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D335342-25mg
25mg
Available within 8-12 weeks(?)
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$89.90

an uncharged derivative of Thioflavin-T

Basic Description

Synonyms Dimethyl-[4-(6-methyl-benzothiazol-2-yl)-phenyl]-amine | doi:10.14272/OEOPVJYUCSQVMJ-UHFFFAOYSA-N.1 | Z3241262804 | 10.14272/OEOPVJYUCSQVMJ-UHFFFAOYSA-N.1 | 2-(4'-(dimethylamino)phenyl)-6-methylbenzothiazole | 2-(4'-(dimethylamino)phenyl)-6-methyl-benzoth
Storage Temp Store at -20°C,Desiccated
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Product Description

2-(4′-(dimethylamino)phenyl)-6-methyl-benzothiazole is an uncharged derivative of Thioflavin-T, displaying 6-fold higher affinity than Thioflavin-T, and shows high affinity for amyloid deposits [Ki = 143 nM for Ab(1-40)]. It can cross the blood brain barrier, and stains both plaques and neurofibrillary tangles in post mortem Alzheimer's disease brain.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Benzothiazoles
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Benzothiazoles
Alternative Parents Dialkylarylamines  Aniline and substituted anilines  Thiazoles  Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents 1,3-benzothiazole - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Monocyclic benzene moiety - Benzenoid - Azole - Thiazole - Heteroaromatic compound - Tertiary amine - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors Not available

Product Properties

Excitation and Emision Ranges λex 356 nm,λem 437 nm in DMSO

Associated Targets(Human)

APP Tclin Amyloid-beta A4 protein (1 Activities)
Activity Type Activity Value -log(M) Mechanism of Action Activity Reference Publications (PubMed IDs)
APP Tclin Amyloid-beta A4 protein (8510 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name N,N-dimethyl-4-(6-methyl-1,3-benzothiazol-2-yl)aniline
INCHI InChI=1S/C16H16N2S/c1-11-4-9-14-15(10-11)19-16(17-14)12-5-7-13(8-6-12)18(2)3/h4-10H,1-3H3
InChIKey OEOPVJYUCSQVMJ-UHFFFAOYSA-N
Smiles CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N(C)C
Isomeric SMILES CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)N(C)C
Molecular Weight 268.38
Reaxy-Rn 198588
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=198588&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 268.400 g/mol
XLogP3 4.700
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 268.103 Da
Monoisotopic Mass 268.103 Da
Topological Polar Surface Area 44.400 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 299.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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