Pumaprazole（BY-841） - Moligand™, ≥99% , CAS No.158364-59-1

CAS: 158364-59-1 Cat. No.: P651635 Peso molecular: 338.40 PubChem CID: 3052764

GRADE & PURITY Moligand™, ≥99%

Synonyms

Pumaprazole | UNII-DK95Z519WL | Methyl 2-(((2,3-dimethylimidazo(1,2-a)pyridin-8-yl)amino)methyl)-3-methylcarbanilate | 8-(2-Methoxycarbonylamino-6-methylbenzylamino)-2,3-dimethylimidazo[1,2-a]pyridine | NZQTVUWEPPDOKK-UHFFFAOYSA-N | DK95Z519WL | EX-A5362

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Pumaprazole is a reversible proton pump antagonist.

In Vivo

Pumaprazole is a reversible proton pump antagonist. Basal acid secretion in the Ghosh-Schild rat is inhibited by Pumaprazole with a higher efficacy compare to ranitidine. Pumaprazole displays identical ID 50 values on day 1 (11 μmol/kg, 95% confidence limits of 5 and 23) and on day 7 (10 μmol/kg, 95% confidence limits of 4 and 23) of a repeated dose study in this model. The lower dose of Pumaprazole (27 μmol/kg) rapidly elevates luminal pH up to almost neutrality, the higher dose (54 μmol/kg) further prolongs this pH-elevating effect . MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:proton pump

Specifications

Sinónimos

Pumaprazole | UNII-DK95Z519WL | Methyl 2-(((2, 3-dimethylimidazo(1, 2-a)pyridin-8-yl)amino)methyl)-3-methylcarbanilate | 8-(2-Methoxycarbonylamino-6-methylbenzylamino)-2, 3-dimethylimidazo[1, 2-a]pyridine | NZQTVUWEPPDOKK-UHFFFAOYSA-N | DK95Z519WL | EX-A5362

Especificaciones y pureza

Moligand™, ≥99%

Mecanismos bioquímicos y fisiológicos

Pumaprazole is a reversible proton pump antagonist.

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C

Enviado en

Ice chest + Ice pads

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

Grado

Moligand™

Pureza

≥99%

Nombres e identificadores

• Sonrisas canónicas: CC1=C(C(=CC=C1)NC(=O)OC)CNC2=CC=CN3C2=NC(=C3C)C
• IUPAC Name: methyl N-[2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylphenyl]carbamate
• InChIKey: NZQTVUWEPPDOKK-UHFFFAOYSA-N
• INCHI: 1S/C19H22N4O2/c1-12-7-5-8-16(22-19(24)25-4)15(12)11-20-17-9-6-10-23-14(3)13(2)21-18(17)23/h5-10,20H,11H2,1-4H3,(H,22,24)
• Isómeros SMILES: CC1=C(C(=CC=C1)NC(=O)OC)CNC2=CC=CN3C2=NC(=C3C)C
• CAS alternativo: 158364-59-1
• PubChem CID: 3052764
• Términos de entrada MeSH: 8-(2-methoxycarbonylamino-6-methyl-phenylmethylamino)-2,3-dimethyl-imidazo (1,2-a)-pyridine;BY 841;BY-841
• Peso molecular: 338.40

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylcarbamic acid esters

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylcarbamic acid esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylcarbamic acid esters
• Alternative Parents: Imidazopyridines Imidazo[1,2-a]pyridines Phenylmethylamines Benzylamines Toluenes Secondary alkylarylamines Aralkylamines Aminopyridines and derivatives N-substituted imidazoles Heteroaromatic compounds Carbamate esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenylcarbamic acid ester - Imidazo[1,2-a]pyridine - Imidazopyridine - Benzylamine - Phenylmethylamine - Aminopyridine - Aralkylamine - Secondary aliphatic/aromatic amine - Toluene - N-substituted imidazole - Pyridine - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Azacycle - Organoheterocyclic compound - Secondary amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: DMSO : 100 mg/mL (295.51 mM; Need ultrasonic)
• Sensibilidad: Light sensitive
• Peso molecular: 338.400 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 338.174 Da
• Monoisotopic Mass: 338.174 Da
• Topological Polar Surface Area: 67.700 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 461.000
• 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