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Home > Encyclopedia > Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1)

Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1)

Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1) structure

Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1) 

structure
  • CAS No:

    120225-64-1

  • Formula:

    C23H29N7O6.Na

  • Chemical Name:

    Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1)

  • Synonyms:

    Benzenepropanoic acid,4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-,sodium salt (1:1);Benzenepropanoic acid,4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-,monosodium salt;CGS 21680C

Description

Off-White Solid

Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1) Basic Attributes

521.50149

522.207701

Characteristics

198

167-174°C

-20°C Freezer

Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1) Use and Manufacturing

A selective A2A receptor agonist

Computed Properties

Molecular Weight:522.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:522.20770095
Monoisotopic Mass:522.20770095
Topological Polar Surface Area:198
Heavy Atom Count:37
Formal Charge:1
Complexity:755
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Guide of Benzenepropanoic acid, 4-[2-[[6-amino-9-(N-ethyl-β-D-ribofuranuronamidosyl)-9H-purin-2-yl]amino]ethyl]-, sodium salt (1:1)

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