(S)-Tenofovir - ≥98% , CAS No.147127-19-3

CAS: 147127-19-3 Cat. No.: T338268 Peso molecular: 287.21 PubChem CID: 122767

GRADE & PURITY ≥98%

Synonyms

(S)-9-(2-Phosphonylmethoxypropyl)adenine | MFCD21604708 | (S)-TDF | SCHEMBL2040329 | AKOS016844118 | ({[(2S)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonic acid | Phosphonic acid, P-[[(1S)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]- | HY

Storage

Conservar a -20°C

Shipped In

Hielera + almohadillas de hielo

Descripción general

descripción del producto：

el (S)-Tenofovir ((S)-GS 1278) es el enantiómero S menos activo del Tenofovir. El tenofovir es un inhibidor nucleotídico de la transcriptasa inversa para tratar el VIH y la hepatitis B crónica (VHB)

Specifications

Sinónimos

(S)-9-(2-Phosphonylmethoxypropyl)adenine | MFCD21604708 | (S)-TDF | SCHEMBL2040329 | AKOS016844118 | ({[(2S)-1-(6-amino-9H-purin-9-yl)propan-2-yl]oxy}methyl)phosphonic acid | Phosphonic acid, P-[[(1S)-2-(6-amino-9H-purin-9-yl)-1-methylethoxy]methyl]- | HY

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Conservar a -20°C

Enviado en

Hielera + almohadillas de hielo

Tipo de acción

INHIBITOR

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504756881
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756881
• Sonrisas canónicas: CC(CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O
• IUPAC Name: [(2S)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethylphosphonic acid
• InChIKey: SGOIRFVFHAKUTI-LURJTMIESA-N
• INCHI: 1S/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m0/s1
• Isómeros SMILES: C[C@@H](CN1C=NC2=C(N=CN=C21)N)OCP(=O)(O)O
• PubChem CID: 122767
• Peso molecular: 287.21

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Imidazopyrimidines
      • Subclass Purines and purine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Imidazopyrimidines
• Subclass: Purines and purine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: 6-aminopurines
• Alternative Parents: Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organophosphorus compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 6-aminopurine - Aminopyrimidine - N-substituted imidazole - Pyrimidine - Imidolactam - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Heteroaromatic compound - Azacycle - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organopnictogen compound - Amine - Primary amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 6-aminopurines. These are purines that carry an amino group at position 6. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole 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

Mecanismos de acción

Propiedades químicas y físicas

• Peso molecular: 287.210 g/mol
• XLogP3: -1.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 287.078 Da
• Monoisotopic Mass: 287.078 Da
• Topological Polar Surface Area: 136.000 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 354.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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