ChemSpider 2D Image | 6-Amino-9-[(3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydro-2-furanyl]-1-(4-nitrobenzyl)-9H-purin-1-ium (non-preferred name) | C19H22N7O6

6-Amino-9-[(3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydro-2-furanyl]-1-(4-nitrobenzyl)-9H-purin-1-ium (non-preferred name)

  • Molecular FormulaC19H22N7O6
  • Average mass444.421 Da
  • Monoisotopic mass444.162598 Da
  • ChemSpider ID24656232

  • Charge - Charge

    defined stereocentres - 3 of 4 defined stereocentres

More details:

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

6-Amino-9-[(3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydro-2-furanyl]-1-(4-nitrobenzyl)-9H-purin-1-ium (non-preferred name) [German] [ACD/IUPAC Name]
6-Amino-9-[(3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydroxytetrahydro-2-furanyl]-1-(4-nitrobenzyl)-9H-purin-1-ium (non-preferred name) [ACD/IUPAC Name]
6-Amino-9-[(3R,4S,5S)-5-(éthylcarbamoyl)-3,4-dihydroxytétrahydro-2-furanyl]-1-(4-nitrobenzyl)-9H-purin-1-ium (non-preferred name) [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 185 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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