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Search term: InChIKey=OPPXXSJNEJKHJA-GQFURFNTSA-N (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N-(L-Threonylcarbamoyl)adenosine | C15H21N7O7

N-(L-Threonylcarbamoyl)adenosine

  • Molecular FormulaC15H21N7O7
  • Average mass411.370 Da
  • Monoisotopic mass411.150238 Da
  • ChemSpider ID29318416
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

Adenosine, N-[[[(2S,3R)-2-amino-3-hydroxy-1-oxobutyl]amino]carbonyl]- [ACD/Index Name]
N-(L-Threonylcarbamoyl)adenosin [German] [ACD/IUPAC Name]
N-(L-Threonylcarbamoyl)adenosine [ACD/IUPAC Name]
N-(L-Thréonylcarbamoyl)adénosine [French] [ACD/IUPAC Name]
N6-threonylcarbamoyladenosine

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.827
Molar Refractivity: 91.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.87
ACD/LogD (pH 5.5): -2.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.45
Polar Surface Area: 218 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 96.7±7.0 dyne/cm
Molar Volume: 208.8±7.0 cm3

Click to predict properties on the Chemicalize site






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