N-(3-((4-Aminobutyl)amino)propyl)acetamide dihydrochloride - Moligand™,≥95% , CAS No.34450-16-3

CAS: 34450-16-3 Cat. No.: N588802 Peso molecular: 260.20 PubChem CID: 214848

GRADE & PURITY Moligand™, ≥95%

Synonyms

N-(3-((4-Aminobutyl)amino)propyl)acetamide 2HCl | Acetamide, N-(3-((4-aminobutyl)amino)propyl)-, dihydrochloride | Acetamide, N-[3-[(4-aminobutyl)amino]propyl]-, dihydrochloride | MFCD00058261 | N-(3-(4-aminobutylamino)propyl)acetamide dihydrochloride | A

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Descripción general

N1-Acetylspermidine hydrochloride is an acetyl derivative of polyamines. N1-Acetylspermidine hydrochloride is a substrate for polyamine oxidase (PAO). N1-Acetylspermidine hydrochloride selectively increases the level of N1- acetylspermidine in human colorectal cancer. N1-Acetylspermidine hydrochloride has a certain cutting efficiency at purine-free sites of DNA

Specifications

Sinónimos

N-(3-((4-Aminobutyl)amino)propyl)acetamide 2HCl | Acetamide, N-(3-((4-aminobutyl)amino)propyl)-, dihydrochloride | Acetamide, N-[3-[(4-aminobutyl)amino]propyl]-, dihydrochloride | MFCD00058261 | N-(3-(4-aminobutylamino)propyl)acetamide dihydrochloride | A

Especificaciones y pureza

Moligand™, ≥95%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Protected from light, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Moligand™

Pureza

≥95%

Nombres e identificadores

• Sonrisas canónicas: CC(=O)NCCCNCCCCN.Cl.Cl
• IUPAC Name: N-[3-(4-aminobutylamino)propyl]acetamide;dihydrochloride
• InChIKey: IVLOLMVLUOGVCZ-UHFFFAOYSA-N
• INCHI: 1S/C9H21N3O.2ClH/c1-9(13)12-8-4-7-11-6-3-2-5-10;;/h11H,2-8,10H2,1H3,(H,12,13);2*1H
• Isómeros SMILES: CC(=O)NCCCNCCCCN.Cl.Cl
• PubChem CID: 214848
• Peso molecular: 260.20

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Acetamides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Acetamides
• Alternative Parents: Secondary carboxylic acid amides Amino acids and derivatives Dialkylamines Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acetamide - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as acetamides. These are organic compounds with the general formula RNHC(=O)CH3, where R= organyl 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

Propiedades químicas y físicas

• Solubilidad: Methanol (Slightly, Heated), Water (Slightly)
• Sensibilidad: Moisture Sensitive
• Punto de fusión (°C): 184-188℃
• Peso molecular: 260.200 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 259.122 Da
• Monoisotopic Mass: 259.122 Da
• Topological Polar Surface Area: 67.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 128.000
• 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: 3

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