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Search term: QIMAEJZEQKSMHZ-UGCAPWQASA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S,3S,4R,5R)-5-{6-[(2,2-Diphenylethyl)amino]-2-fluoro-9H-purin-9-yl}-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide | C26H27FN6O4

(2S,3S,4R,5R)-5-{6-[(2,2-Diphenylethyl)amino]-2-fluoro-9H-purin-9-yl}-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide

  • Molecular FormulaC26H27FN6O4
  • Average mass506.529 Da
  • Monoisotopic mass506.207794 Da
  • ChemSpider ID28518555

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3S,4R,5R)-5-{6-[(2,2-Diphenylethyl)amino]-2-fluor-9H-purin-9-yl}-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamid [German] [ACD/IUPAC Name]
(2S,3S,4R,5R)-5-{6-[(2,2-Diphenylethyl)amino]-2-fluoro-9H-purin-9-yl}-N-ethyl-3,4-dihydroxytetrahydro-2-furancarboxamide [ACD/IUPAC Name]
(2S,3S,4R,5R)-5-{6-[(2,2-Diphényléthyl)amino]-2-fluoro-9H-purin-9-yl}-N-éthyl-3,4-dihydroxytétrahydro-2-furanecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.700
Molar Refractivity: 132.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.79
ACD/KOC (pH 5.5): 512.09
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.79
ACD/KOC (pH 7.4): 512.09
Polar Surface Area: 134 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 58.1±7.0 dyne/cm
Molar Volume: 342.7±7.0 cm3

Click to predict properties on the Chemicalize site


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