ChemSpider 2D Image | 2-[(3'R)-1,3'-Bipyrrolidin-1'-yl]-N-(2,2-diphenylethyl)adenosine | C32H39N7O4

2-[(3'R)-1,3'-Bipyrrolidin-1'-yl]-N-(2,2-diphenylethyl)adenosine

  • Molecular FormulaC32H39N7O4
  • Average mass585.697 Da
  • Monoisotopic mass585.306335 Da
  • ChemSpider ID10022793
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

2-[(3'R)-1,3'-Bipyrrolidin-1'-yl]-N-(2,2-diphenylethyl)adenosin [German] [ACD/IUPAC Name]
2-[(3'R)-1,3'-Bipyrrolidin-1'-yl]-N-(2,2-diphenylethyl)adenosine [ACD/IUPAC Name]
2-[(3'R)-1,3'-Bipyrrolidin-1'-yl]-N-(2,2-diphényléthyl)adénosine [French] [ACD/IUPAC Name]
Adenosine, 2-[(3'R)-[1,3'-bipyrrolidin]-1'-yl]-N-(2,2-diphenylethyl)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.0 g/cm3
Boiling Point: 879.8±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 134.0±0.0 kJ/mol
Flash Point: 485.9±0.0 °C
Index of Refraction: 1.742
Molar Refractivity: 160.2±0.0 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 3.11
ACD/KOC (pH 5.5): 9.76
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 25.57
ACD/KOC (pH 7.4): 80.14
Polar Surface Area: 132 Å2
Polarizability: 63.5±0.0 10-24cm3
Surface Tension: 64.5±0.0 dyne/cm
Molar Volume: 396.6±0.0 cm3

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