Omeprazol sódico - ≥97% , CAS No.95510-70-6

CAS: 95510-70-6 Cat. No.: O305031 Peso molecular: 367.41 Número EC: 623-285-9

GRADE & PURITY ≥97%

Synonyms

D01207 | BCP9000660 | Monosodio (RS)-5-Metoxi-2-(((4-metoxi-3,5-dimetilpiridin-2-il)metil)sulfinil)-1H-benzoimidazol monohidrato | SW219428-1 | BIM-0007845.P001 | AB01274809-01 | CHEBI:31934 | H 168/68 sodio | OMEPRAZOLE SODIUM [WHO-DD] | Q272824

Storage

Conservar a -20°C

Shipped In

Hielera + almohadillas de hielo

Descripción general

El omeprazol sódico (H 16868 sódico), un inhibidor de la bomba de protones (IBP), está disponible para el tratamiento de trastornos gastrointestinales relacionados con la acidez. El omeprazol sódico muestra una inhibición competitiva de la actividad CYP2C19 con un Ki de 2 a 6 μM. El omeprazol sódico también inhibe el crecimiento de bacterias Gram-positivas y Gram-negativas. El omeprazol es un potente inhibidor de la esfingomielinasa neutra (N-SMasa) penetrante en el cerebro (inhibidor de exosomas).

Specifications

Sinónimos

D01207 | BCP9000660 | Monosodio (RS)-5-Metoxi-2-(((4-metoxi-3, 5-dimetilpiridin-2-il)metil)sulfinil)-1H-benzoimidazol monohidrato | SW219428-1 | BIM-0007845.P001 | AB01274809-01 | CHEBI:31934 | H 168/68 sodio | OMEPRAZOLE SODIUM [WHO-DD] | Q272824

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Conservar a -20°C

Enviado en

Hielera + almohadillas de hielo

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504765788
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504765788
• Sonrisas canónicas: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC.[Na+]
• IUPAC Name: sodium;5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-1-ide
• InChIKey: RYXPMWYHEBGTRV-UHFFFAOYSA-N
• INCHI: 1S/C17H18N3O3S.Na/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;/h5-8H,9H2,1-4H3;/q-1;+1
• Isómeros SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C([N-]2)C=CC(=C3)OC.[Na+]
• Peso molecular: 367.41
• Reaxy-Rn: 11512125
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=11512125&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Benzimidazoles
      • Subclass Sulfinylbenzimidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Benzimidazoles
• Subclass: Sulfinylbenzimidazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Sulfinylbenzimidazoles
• Alternative Parents: Anisoles Methylpyridines Alkyl aryl ethers Imidazoles Heteroaromatic compounds Sulfoxides Sulfinyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Sulfinylbenzimidazole - Anisole - Alkyl aryl ether - Methylpyridine - Pyridine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Sulfoxide - Ether - Azacycle - Organic alkali metal salt - Sulfinyl compound - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic sodium salt - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as sulfinylbenzimidazoles. These are polycyclic aromatic compounds containing a sulfinyl group attached at the position 2 of a benzimidazole moiety.
• 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

• Punto de inflamación (°C): 316.7ºC
• Punto de ebullición (°C): 600ºC
• Punto de fusión (°C): 220°C
• Peso molecular: 367.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 367.097 Da
• Monoisotopic Mass: 367.097 Da
• Topological Polar Surface Area: 81.500 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 459.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Xiao-yu Xu, Zhe-yan Zhang, Xiao-dan Zhang, Jian-chao Luo, Yun-shan Zhong, Le-hao Jin, Da-peng Dai, Jian-chang Qian.  (2024)  Critical considerations for co-administering rivaroxaban and vonoprazan: Unveiling potential pharmacokinetic interactions.  CHEMICO-BIOLOGICAL INTERACTIONS,      [PMID:39643151] [10.1016/j.cbi.2024.111342]

2. Lin Xi, Hu Shiyun, Li Yanxia, Yu Lishuang, Huang Lu.  (2025)  Enantioseparation by cLC-UV using chiral packed capillary columns with photonic crystal fibers as frits.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,      [PMID:40715534] [10.1007/s00216-025-06020-w]

3. Xiaoyu Chen, Baian Ji, Meiling Zhou, Hanwen Deng, Min Wang, Zhining Xia.  (2025)  Affinity Capillary Electrophoresis Based on Receptor Quasi-Immobilization for the Study of Interactions Between Drugs and Serum Albumin.  JOURNAL OF SEPARATION SCIENCE,  48  (4): (e70142).  [PMID:40259547] [10.1002/jssc.70142]