ChemSpider 2D Image | (2R)-N-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-2-(methylamino)propanamide | C14H21N7O4

(2R)-N-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-2-(methylamino)propanamide

  • Molecular FormulaC14H21N7O4
  • Average mass351.361 Da
  • Monoisotopic mass351.165497 Da
  • ChemSpider ID26613318

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5'-Deoxy-5'-[(N-methyl-D-alanyl)amino]adenosine [ACD/IUPAC Name]
5'-Desoxy-5'-[(N-methyl-D-alanyl)amino]adenosin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-[(N-méthyl-D-alanyl)amino]adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-deoxy-5'-[[(2R)-2-(methylamino)-1-oxopropyl]amino]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.782
Molar Refractivity: 84.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -3.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 76.4±7.0 dyne/cm
Molar Volume: 200.1±7.0 cm3

Click to predict properties on the Chemicalize site


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