N3-C5-NHS ester - ≥98% , CAS No.866363-70-4

CAS: 866363-70-4 Cat. No.: N651731 Fórmula: C₁₀H₁₄N₄O₄ Peso molecular: 254.25 PubChem CID: 11594035

GRADE & PURITY ≥98%

Synonyms

1-[(6-Azidohexanoyl)oxy]pyrrolidine-2,5-dione | FVWGCTQOFSJEDB-UHFFFAOYSA-N | PD125930 | 6-azido-hexanoic acid 2,5-dioxo-pyrrolidin-1-yl ester | DTXSID10469149 | Hexanoic acid, 6-azido-, 2,5-dioxo-1-pyrrolidinyl ester | BP-25454 | A1-06739 | HY-126523 | 2

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

N3-C5-NHS ester is a noncleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs) .

Form:Liquid

IC50& Target:Non-cleavable

Specifications

Sinónimos

1-[(6-Azidohexanoyl)oxy]pyrrolidine-2,5-dione | FVWGCTQOFSJEDB-UHFFFAOYSA-N | PD125930 | 6-azido-hexanoic acid 2,5-dioxo-pyrrolidin-1-yl ester | DTXSID10469149 | Hexanoic acid, 6-azido-, 2,5-dioxo-1-pyrrolidinyl ester | BP-25454 | A1-06739 | HY-126523 | 2

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

N3-C5-NHS ester is a noncleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs) .

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%

Nomes e identificadores

• Sorrisos canónicos: C1CC(=O)N(C1=O)OC(=O)CCCCCN=[N+]=[N-]
• IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 6-azidohexanoate
• InChIKey: FVWGCTQOFSJEDB-UHFFFAOYSA-N
• INCHI: 1S/C10H14N4O4/c11-13-12-7-3-1-2-4-10(17)18-14-8(15)5-6-9(14)16/h1-7H2
• SMILES isoméricas: C1CC(=O)N(C1=O)OC(=O)CCCCCN=[N+]=[N-]
• PubChem CID: 11594035
• Peso molecular: 254.25

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyrrolidines
      • Subclass Pyrrolidones

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyrrolidines
• Subclass: Pyrrolidones
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolidine-2-ones
• Alternative Parents: Dicarboximides Lactams Azo imides Azo compounds Monocarboxylic acids and derivatives Azacyclic compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 2-pyrrolidone - Dicarboximide - Azo compound - Azo imide - Lactam - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic zwitterion - Organic salt - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyrrolidine-2-ones. These are pyrrolidines which bear a C=O group at position 2 of the pyrrolidine ring.
• 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

Propriedades químicas e físicas

• Solubilidade: DMSO : 100 mg/mL (393.33 mM; Need ultrasonic)
• Peso molecular: 254.240 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 254.102 Da
• Monoisotopic Mass: 254.102 Da
• Topological Polar Surface Area: 78.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 373.000
• 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