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Search term: VICVZCMBYDYFRR-QCUYGVNKSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S,3S,4R,5R)-3,4-Dihydroxy-N-methyl-5-[6-(methylamino)-2-(2-pyridinylethynyl)-9H-purin-9-yl]tetrahydro-2-furancarboxamide | C19H19N7O4

(2S,3S,4R,5R)-3,4-Dihydroxy-N-methyl-5-[6-(methylamino)-2-(2-pyridinylethynyl)-9H-purin-9-yl]tetrahydro-2-furancarboxamide

  • Molecular FormulaC19H19N7O4
  • Average mass409.399 Da
  • Monoisotopic mass409.149841 Da
  • ChemSpider ID24637886

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3S,4R,5R)-3,4-Dihydroxy-N-methyl-5-[6-(methylamino)-2-(2-pyridinylethinyl)-9H-purin-9-yl]tetrahydro-2-furancarboxamid [German] [ACD/IUPAC Name]
(2S,3S,4R,5R)-3,4-Dihydroxy-N-methyl-5-[6-(methylamino)-2-(2-pyridinylethynyl)-9H-purin-9-yl]tetrahydro-2-furancarboxamide [ACD/IUPAC Name]
(2S,3S,4R,5R)-3,4-Dihydroxy-N-méthyl-5-[6-(méthylamino)-2-(2-pyridinyléthynyl)-9H-purin-9-yl]tétrahydro-2-furanecarboxamide [French] [ACD/IUPAC Name]
2-(2-Pyridinyl)ethynyl-N6-methyl-5'-N-methylcarboxamidoadenosine

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.749
Molar Refractivity: 105.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.78
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.81
Polar Surface Area: 147 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 66.7±7.0 dyne/cm
Molar Volume: 259.8±7.0 cm3

Click to predict properties on the Chemicalize site


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