ChemSpider 2D Image | 1-(5-S-Isobutyl-5-thio-D-ribofuranosyl)-1H-imidazo[4,5-c]pyridin-4-amine | C15H22N4O3S

1-(5-S-Isobutyl-5-thio-D-ribofuranosyl)-1H-imidazo[4,5-c]pyridin-4-amine

  • Molecular FormulaC15H22N4O3S
  • Average mass338.425 Da
  • Monoisotopic mass338.141266 Da
  • ChemSpider ID24668049
  • defined stereocentres - 3 of 4 defined stereocentres


More details:






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

1-(5-S-Isobutyl-5-thio-D-ribofuranosyl)-1H-imidazo[4,5-c]pyridin-4-amin [German] [ACD/IUPAC Name]
1-(5-S-Isobutyl-5-thio-D-ribofuranosyl)-1H-imidazo[4,5-c]pyridin-4-amine [ACD/IUPAC Name]
1-(5-S-Isobutyl-5-thio-D-ribofuranosyl)-1H-imidazo[4,5-c]pyridin-4-amine [French] [ACD/IUPAC Name]
1H-Imidazo[4,5-c]pyridin-4-amine, 1-[5-S-(2-methylpropyl)-5-thio-D-ribofuranosyl]- [ACD/Index Name]
2-(4-Amino-imidazo[4,5-c]pyridin-1-yl)-5-isobutylsulfanylmethyl-tetrahydro-furan-3,4-diol

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

Density: 1.5±0.1 g/cm3
Boiling Point: 627.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 333.3±34.3 °C
Index of Refraction: 1.719
Molar Refractivity: 86.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.28
ACD/LogD (pH 5.5): -0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.75
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 3.71
ACD/KOC (pH 7.4): 61.12
Polar Surface Area: 132 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 61.7±7.0 dyne/cm
Molar Volume: 219.4±7.0 cm3

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