ChemSpider 2D Image | N-Benzoyl-5'-O-sulfamoyladenosine | C17H18N6O7S

N-Benzoyl-5'-O-sulfamoyladenosine

  • Molecular FormulaC17H18N6O7S
  • Average mass450.426 Da
  • Monoisotopic mass450.095764 Da
  • ChemSpider ID76774808

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Adenosine, 5'-O-(aminosulfonyl)-N-benzoyl- [ACD/Index Name]
N-Benzoyl-5'-O-sulfamoyladenosin [German] [ACD/IUPAC Name]
N-Benzoyl-5'-O-sulfamoyladenosine [ACD/IUPAC Name]
N-Benzoyl-5'-O-sulfamoyladénosine [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.798
Molar Refractivity: 103.9±0.5 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.65
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.40
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.55
Polar Surface Area: 200 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 89.2±7.0 dyne/cm
Molar Volume: 243.5±7.0 cm3

Click to predict properties on the Chemicalize site


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