ChemSpider 2D Image | 5'-O-{[(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)carbonyl]sulfamoyl}adenosine | C18H24N8O7S

5'-O-{[(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)carbonyl]sulfamoyl}adenosine

  • Molecular FormulaC18H24N8O7S
  • Average mass496.498 Da
  • Monoisotopic mass496.148865 Da
  • ChemSpider ID128437326

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

5'-O-{[(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)carbonyl]sulfamoyl}adenosin [German] [ACD/IUPAC Name]
5'-O-{[(3-Isopropyl-1-methyl-1H-pyrazol-5-yl)carbonyl]sulfamoyl}adenosine [ACD/IUPAC Name]
5'-O-{[(3-Isopropyl-1-méthyl-1H-pyrazol-5-yl)carbonyl]sulfamoyl}adénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-O-[[[[1-methyl-3-(1-methylethyl)-1H-pyrazol-5-yl]carbonyl]amino]sulfonyl]- [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: 1.786
Molar Refractivity: 114.9±0.5 cm3
#H bond acceptors: 15
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.11
ACD/LogD (pH 5.5): -2.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 218 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 81.5±7.0 dyne/cm
Molar Volume: 272.4±7.0 cm3

Click to predict properties on the Chemicalize site


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