WAY-347453 - ≥98% , CAS No.433704-82-6

CAS: 433704-82-6 Cat. No.: W417478 Fórmula: C₂₃H₂₈N₂O₃ Peso molecular: 380.5 PubChem CID: 1325708

GRADE & PURITY ≥98%

Synonyms

N-[2-(4-methoxyphenyl)ethyl]-1-(2-methylbenzoyl)-4-Piperidinecarboxamide

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Inhibitors of Glutathione S-Transferase Omega 1

Specifications

Sinónimos

N-[2-(4-methoxyphenyl)ethyl]-1-(2-methylbenzoyl)-4-Piperidinecarboxamide

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Propriedades do produto

ALogP

3.052

Ligação rotativa

4

Nomes e identificadores

Pubchem Sid

504760465

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504760465

Sorrisos canónicos

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)OC

IUPAC Name

N-[2-(4-methoxyphenyl)ethyl]-1-(2-methylbenzoyl)piperidine-4-carboxamide

InChIKey

UTSUBQVCTPCCQF-UHFFFAOYSA-N

INCHI

1S/C23H28N2O3/c1-17-5-3-4-6-21(17)23(27)25-15-12-19(13-16-25)22(26)24-14-11-18-7-9-20(28-2)10-8-18/h3-10,19H,11-16H2,1-2H3,(H,24,26)

SMILES isoméricas

CC1=CC=CC=C1C(=O)N2CCC(CC2)C(=O)NCCC3=CC=C(C=C3)OC

PubChem CID

1325708

Peso molecular

380.5

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-benzoylpiperidines
• Alternative Parents: N-benzoylpiperidines o-Toluamides Piperidinecarboxamides Benzamides Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Tertiary carboxylic acid amides Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-benzoylpiperidine - 1-benzoylpiperidine - Piperidinecarboxamide - N-acyl-piperidine - Toluamide - O-toluamide - Benzoic acid or derivatives - Benzamide - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Alkyl aryl ether - Toluene - Piperidine - Tertiary carboxylic acid amide - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 1-benzoylpiperidines. These are compounds containing a piperidine ring substituted at the 1-position with a benzoyl 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.

DOI: 10.1186/s13321-016-0174-y

Alvos associados (humanos)

GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)

Discover Target: GNAS

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ERG Tbio Transcriptional regulator ERG (5589 Activities)

Discover Target: ERG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CBX1 Tbio Chromobox protein homolog 1 (92434 Activities)

Discover Target: CBX1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Alvos associados (não humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• DMSO (mM) Solubilidade máxima: 10

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. 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 433704-82-6, the molecular formula is C23H28N2O3, and the molecular weight is 380.5 g/mol. InChIKey UTSUBQVCTPCCQF-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.