ChemSpider 2D Image | 5'-Deoxy-5'-({4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethoxy]benzyl}amino)adenosine | C22H24N8O5S

5'-Deoxy-5'-({4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethoxy]benzyl}amino)adenosine

  • Molecular FormulaC22H24N8O5S
  • Average mass512.542 Da
  • Monoisotopic mass512.159058 Da
  • ChemSpider ID26395327

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-Deoxy-5'-({4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethoxy]benzyl}amino)adenosine [ACD/IUPAC Name]
5'-Desoxy-5'-({4-[2-oxo-2-(1,3-thiazol-2-ylamino)ethoxy]benzyl}amino)adenosin [German] [ACD/IUPAC Name]
5'-Désoxy-5'-({4-[2-oxo-2-(1,3-thiazol-2-ylamino)éthoxy]benzyl}amino)adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-deoxy-5'-[[[4-[2-oxo-2-(2-thiazolylamino)ethoxy]phenyl]methyl]amino]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.807
Molar Refractivity: 128.5±0.5 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 1.66
ACD/LogD (pH 5.5): -2.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.21
Polar Surface Area: 211 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 80.3±7.0 dyne/cm
Molar Volume: 298.8±7.0 cm3

Click to predict properties on the Chemicalize site


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