ChemSpider 2D Image | (2S)-3-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]-2-hydroxypropyl D-valinate | C14H22N6O5

(2S)-3-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]-2-hydroxypropyl D-valinate

  • Molecular FormulaC14H22N6O5
  • Average mass354.362 Da
  • Monoisotopic mass354.165161 Da
  • ChemSpider ID48062798

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-3-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]-2-hydroxypropyl D-valinate [ACD/IUPAC Name]
(2S)-3-[(2-Amino-6-oxo-1,6-dihydro-9H-purin-9-yl)methoxy]-2-hydroxypropyl-D-valinat [German] [ACD/IUPAC Name]
D-Valinate de (2S)-3-[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)méthoxy]-2-hydroxypropyle [French] [ACD/IUPAC Name]
D-Valine, (2S)-3-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]-2-hydroxypropyl ester [ACD/Index Name]
(R)-(S)-2-hydroxy-3-((2-imino-6-oxo-2,3-dihydro-1H-purin-9(6H)-yl)methoxy)propyl 2-amino-3-methylbutanoate
(R,S)-Iso Valganciclovir
(S)-(R)-3-((2-Amino-6-oxo-1H-purin-9(6H)-yl)methoxy)-2-hydroxypropyl 2-amino-3-methylbutanoate
[(2S)-3-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]-2-hydroxypropyl] (2R)-2-amino-3-methylbutanoate
1356847-27-2 [RN]
1356932-18-7 [RN]

    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: 1.678
    Molar Refractivity: 83.9±0.5 cm3
    #H bond acceptors: 11
    #H bond donors: 6
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: -1.13
    ACD/LogD (pH 5.5): -3.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.28
    Polar Surface Area: 167 Å2
    Polarizability: 33.3±0.5 10-24cm3
    Surface Tension: 65.6±7.0 dyne/cm
    Molar Volume: 222.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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