WAY-353519 - ≥97% , CAS No.690247-68-8

CAS: 690247-68-8 Cat. No.: W418376 Fórmula: C20H21N3O3S2 Peso molecular: 415.52904 PubChem CID: 1249013
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
3-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-yl)benzamide | 3-(azepan-1-ylsulfonyl)-N-(benzo[d]thiazol-2-yl)benzamide
Storage
Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
★
Size
Alemania (EU)
USA*
Price
Qty
5mg
W418376-5mg
—
3 Disponible

225,53€

299,28€
Guardar 73,76 € (24.64%)
25mg
W418376-25mg
—
3 Disponible

804,31€

1.043,80€
Guardar 239,50 € (22.94%)
50mg
W418376-50mg
—
3 Disponible

1.378,75€

1.788,32€
Guardar 409,57 € (22.90%)
100mg
W418376-100mg
—
3 Disponible

2.298,55€

2.980,60€
Guardar 682,04 € (22.88%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C,Argon charged Ships Ice chest + Ice pads 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.

📚

Literature proof

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

Descripción general

modulating sirtuin activity; modulating sirtuin activity;

Specifications

Sinónimos
3-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-yl)benzamide | 3-(azepan-1-ylsulfonyl)-N-(benzo[d]thiazol-2-yl)benzamide
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Store at -20°C,Argon charged
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥97%
Propiedades del producto
ALogP
3.73
Recuento HBD
1
Enlace rotable
4
Nombres e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504760435
Sonrisas canónicas
C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3
IUPAC Name
3-(azepan-1-ylsulfonyl)-N-(1,3-benzothiazol-2-yl)benzamide
InChIKey
VUSOEUOYUTXRTG-UHFFFAOYSA-N
INCHI
1S/C20H21N3O3S2/c24-19(22-20-21-17-10-3-4-11-18(17)27-20)15-8-7-9-16(14-15)28(25,26)23-12-5-1-2-6-13-23/h3-4,7-11,14H,1-2,5-6,12-13H2,(H,21,22,24)
Isómeros SMILES
C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3
PubChem CID
1249013
Peso molecular
415.52904

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
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassBenzenesulfonamides
Intermediate Tree Nodes Not available
Direct ParentBenzenesulfonamides
Alternative Parents Benzamides  Benzenesulfonyl compounds  Benzothiazoles  Benzoyl derivatives  Azepanes  Organosulfonamides  Heteroaromatic compounds  Sulfonyls  Thiazoles  Secondary carboxylic acid amides  Azacyclic compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  Organopnictogen compounds  Organooxygen compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzenesulfonamide - Benzamide - Benzoic acid or derivatives - Benzenesulfonyl group - 1,3-benzothiazole - Benzoyl - Azepane - Organosulfonic acid amide - Azole - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiazole - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeFechaArticulo
I2222146Certificate of AnalysisJul 10, 2025 W418376
I2222147Certificate of AnalysisJul 10, 2025 W418376
I2222148Certificate of AnalysisJul 10, 2025 W418376
I2222149Certificate of AnalysisJul 10, 2025 W418376
Propiedades químicas y físicas
DMSO (mM) Solubilidad máxima10
Peso molecular415.500 g/mol
XLogP33.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass415.102 Da
Monoisotopic Mass415.102 Da
Topological Polar Surface Area116.000 Ų
Heavy Atom Count28
Formal Charge0
Complexity644.000
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
Calculadoras de soluciones
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