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· · COA & SDS available for every product · Same-day shipping on in-stock items TB 21007 - ≥99%(HPLC) , CAS No.207306-50-1
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
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Why this grade ≥99%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
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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 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
Specifications & Purity
≥99%(HPLC)
Biochemical and Physiological Mechanisms
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
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles 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 Isomeric SMILES CC1(CC2=C(SC(=C2C(=O)C1)SCCO)C3=NC=CS3)C PubChem CID 6918633 Molecular Weight 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 Kingdom Organic compounds Superclass Organosulfur compounds Class Thioethers Subclass Aryl thioethers Intermediate Tree Nodes Not available Direct Parent Aryl 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 Framework Aromatic 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 Description This 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 Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Solvent:DMSO, Max Conc. mg/mL: 33.95, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 8.49, Max Conc. mM: 25 Molecular Weight 339.500 g/mol XLogP3 3.400 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 4 Exact Mass 339.042 Da Monoisotopic Mass 339.042 Da Topological Polar Surface Area 132.000 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 404.000 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
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