TB 21007 - ≥99%(HPLC) , CAS No.207306-50-1

CAS: 207306-50-1 Cat. No.: T288798 Formule: C15H17NO2S3 Poids moléculaire: 339.5 PubChem CID: 6918633
DISPONIBLE À COMMANDE
GRADE & PURITY ≥99%(HPLC)
Synonyms
UNII-VL2NQQ83RN | 6,7-Dihydro-3-((2-hydroxyethyl)thio)-6,6-dimethyl-1-(2-thiazolyl)benzo(C)thiophen-4(5H)-one | Benzo(C)thiophen-4(5H)-one, 6,7-dihydro-3-((2-hydroxyethyl)thio)-6,6-dimethyl-1-(2-thiazolyl)- | TB21007 | TB-21007 | J-013563 | TB 21007 | Ben
Storage
Store at 2-8°C
Shipped In
Wet ice
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Size
Allemagne (EU)
USA*
Price
Qty
10mg
T288798-10mg
Sur commande · 8–12 semaines
320,11€
50mg
T288798-50mg
Sur commande · 8–12 semaines
1 344,91€
Enter a quantity for the sizes you want to add.
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Why this grade

≥99%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonymes
UNII-VL2NQQ83RN | 6,7-Dihydro-3-((2-hydroxyethyl)thio)-6,6-dimethyl-1-(2-thiazolyl)benzo(C)thiophen-4(5H)-one | Benzo(C)thiophen-4(5H)-one, 6,7-dihydro-3-((2-hydroxyethyl)thio)-6,6-dimethyl-1-(2-thiazolyl)- | TB21007 | TB-21007 | J-013563 | TB 21007 | Ben
Spécifications et pureté
≥99%(HPLC)
Mécanismes biochimiques et physiologiques
GABAAreceptor inverse agonist selective for theα5-subtype (Kivalues are 1.6, 16, 20 and 20 nM forα5,α2,α1 andα3 subtypes respectively). Brain penetrant; enhances cognitive performance in rats in the delayed matching-to-place morris water maze test followi
Conditions de stockage de stockage
Store at 2-8°C
Expédié en
Wet ice
Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.
Pureté
≥99%(HPLC)
Noms et identifiants
Sourires canoniques
CC1(CC2=C(SC(=C2C(=O)C1)SCCO)C3=NC=CS3)C
IUPAC Name
3-(2-hydroxyethylsulfanyl)-6,6-dimethyl-1-(1,3-thiazol-2-yl)-5,7-dihydro-2-benzothiophen-4-one
InChIKey
QILRYFCEXLFIDS-UHFFFAOYSA-N
INCHI
1S/C15H17NO2S3/c1-15(2)7-9-11(10(18)8-15)14(20-6-4-17)21-12(9)13-16-3-5-19-13/h3,5,17H,4,6-8H2,1-2H3
Isomères SMILES
CC1(CC2=C(SC(=C2C(=O)C1)SCCO)C3=NC=CS3)C
PubChem CID
6918633
Poids moléculaire
339.5

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganosulfur compounds
ClasseThioethers
SubclassAryl thioethers
Intermediate Tree Nodes Not available
Direct ParentAryl thioethers
Alternative Parents Aryl alkyl ketones  Alkylarylthioethers  Vinylogous thioesters  Thiophenes  Thiazoles  Heteroaromatic compounds  Sulfenyl compounds  Azacyclic compounds  Primary alcohols  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Aryl ketone - Aryl thioether - Aryl alkyl ketone - Alkylarylthioether - Vinylogous thioester - Azole - Thiazole - Thiophene - Heteroaromatic compound - Ketone - Sulfenyl compound - Organoheterocyclic compound - Azacycle - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alcohol - Primary alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.
External Descriptors Not available
Structure 3D
Modèle de structure chimique interactif





Cibles associées (humaines)
GABRA5 Tclin GABA receptor alpha-5 subunit (699 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
U2OS (164939 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LRRK2 Tchem Leucine-rich repeat serine/threonine-protein kinase 2 (6390 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRG2 Tclin GABA-A receptor; alpha-3/beta-3/gamma-2 (1250 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRA1 Tclin GABA-A receptor; alpha-1/beta-3/gamma-2 (1565 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRG2 Tclin GABA-A receptor; alpha-5/beta-3/gamma-2 (1334 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRG2 Tclin GABA-A receptor; alpha-2/beta-3/gamma-2 (949 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HEK-293T (167025 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Cibles associées (non humaines)
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mécanismes d'action
Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriétés chimiques et physiques
SolubilitéSolvent:DMSO, Max Conc. mg/mL: 33.95, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 8.49, Max Conc. mM: 25
Poids moléculaire339.500 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass339.042 Da
Monoisotopic Mass339.042 Da
Topological Polar Surface Area132.000 Ų
Heavy Atom Count21
Formal Charge0
Complexity404.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculateurs de solution
Avis

Avis des clients

Foire aux questions

What is the purity of this product, and how is it determined?
This product is supplied at ≥99% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.
How is this product shipped?
This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 207306-50-1, the molecular formula is C??H??NO?S?, and the molecular weight is 339.5 g/mol. InChIKey QILRYFCEXLFIDS-UHFFFAOYSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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