ChemSpider 2D Image | 4-amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methyl-pteridin-7-one | C12H15N5O4

4-amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methyl-pteridin-7-one

  • Molecular FormulaC12H15N5O4
  • Average mass293.279 Da
  • Monoisotopic mass293.112396 Da
  • ChemSpider ID23935276

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

195442-55-8 [RN]
4-amino-6-methyl-8-(2-deoxy-??-d-ribofuranosyl)-7(8h)-pteridone
4-Amino-6-methyl-8-(2-deoxy-?-D-ribofuranosyl)-7(8H)-pteridone
4-Amino-6-methyl-8-(2-deoxy-b-D-ribofuranosyl)-7(8H)-pteridone
4-Amino-6-methyl-8-(2-deoxy-β-D-ribofuranosyl)-7(8H)-pteridone
4-amino-8-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-methylpteridin-7-one

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 644.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 99.9±3.0 kJ/mol
    Flash Point: 343.5±34.3 °C
    Index of Refraction: 1.813
    Molar Refractivity: 69.0±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -2.69
    ACD/LogD (pH 5.5): -1.18
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.24
    ACD/LogD (pH 7.4): -1.14
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.68
    Polar Surface Area: 134 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 83.8±7.0 dyne/cm
    Molar Volume: 159.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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