Nω-Acetylhistamine - ≥98% , CAS No.673-49-4

CAS: 673-49-4 Cat. No.: N340451 Formula: C₇H₁₁N₃O Peso molecolare: 153.18

GRADE & PURITY ≥98%

Synonyms

Acetamide, N-(2-imidazol-4-ylethyl)- (8CI) | Acetylhistamine, N- | XJWPISBUKWZALE-UHFFFAOYSA-N | SCHEMBL12999042 | CHEBI:28483 | N-[2-(1H-imidazol-5-yl)ethyl]acetamide | Acetamide, {N-[2-(1H-imidazol-4-yl)ethyl]-} | N omega -Acetylhistamine | N-[2-(1H-Imi

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinonimi

Acetamide, N-(2-imidazol-4-ylethyl)- (8CI) | Acetylhistamine, N- | XJWPISBUKWZALE-UHFFFAOYSA-N | SCHEMBL12999042 | CHEBI:28483 | N-[2-(1H-imidazol-5-yl)ethyl]acetamide | Acetamide, {N-[2-(1H-imidazol-4-yl)ethyl]-} | N omega -Acetylhistamine | N-[2-(1H-Imi

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 504754416
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754416
• Sorrisi canonici: CC(=O)NCCC1=CN=CN1
• IUPAC Name: N-[2-(1H-imidazol-5-yl)ethyl]acetamide
• InChIKey: XJWPISBUKWZALE-UHFFFAOYSA-N
• INCHI: 1S/C7H11N3O/c1-6(11)9-3-2-7-4-8-5-10-7/h4-5H,2-3H2,1H3,(H,8,10)(H,9,11)
• Isomeri SMILES: CC(=O)NCCC1=CN=CN1
• Peso molecolare: 153.18
• Reaxy-Rn: 778361
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=778361&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Acetamides
            • Level7 N-acetyl-2-arylethylamines

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides - Acetamides
• Direct Parent: N-acetyl-2-arylethylamines
• Alternative Parents: Imidazoles Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-acetyl-2-arylethylamine - Azole - Imidazole - Heteroaromatic compound - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as n-acetyl-2-arylethylamines. These are compounds containing an acetamide group that is N-linked to an arylethylamine.
• External Descriptors: imidazoles - acetamides

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

Obiettivi associati (umani)

GMNN Tbio Geminin (128009 Activities)

Discover Target: GMNN

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

Obiettivi associati (non umani)

Plasmodium falciparum (966862 Activities)

Explore this target

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

fba Putative fructose-1,6-bisphosphate aldolase (15559 Activities)

Discover Target: fba

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Punto di fusione (°C): 147-149°C (lit.)
• Peso molecolare: 153.180 g/mol
• XLogP3: -0.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 153.09 Da
• Monoisotopic Mass: 153.09 Da
• Topological Polar Surface Area: 57.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

Domande frequenti

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 673-49-4, the molecular formula is C7H11N3O, and the molecular weight is 153.18 g/mol. InChIKey XJWPISBUKWZALE-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.