ChemSpider 2D Image | 4-({[(4S)-2,6-Dioxohexahydro-4-pyrimidinyl]carbonyl}amino)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanine | C19H24N4O7

4-({[(4S)-2,6-Dioxohexahydro-4-pyrimidinyl]carbonyl}amino)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanine

  • Molecular FormulaC19H24N4O7
  • Average mass420.417 Da
  • Monoisotopic mass420.164490 Da
  • ChemSpider ID68007811

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-({[(4S)-2,6-Dioxohexahydro-4-pyrimidinyl]carbonyl}amino)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanin [German] [ACD/IUPAC Name]
4-({[(4S)-2,6-Dioxohexahydro-4-pyrimidinyl]carbonyl}amino)-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-phenylalanine [ACD/IUPAC Name]
4-({[(4S)-2,6-Dioxohexahydro-4-pyrimidinyl]carbonyl}amino)-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}-L-phénylalanine [French] [ACD/IUPAC Name]
L-Phenylalanine, N-[(1,1-dimethylethoxy)carbonyl]-4-[[[(4S)-hexahydro-2,6-dioxo-4-pyrimidinyl]carbonyl]amino]- [ACD/Index Name]
(S)-2-((tert-butoxycarbonyl)amino)-3-(4-((S)-2,6-dioxohexahydropyrimidine-4-carboxamido)phenyl)propanoic acid
324017-29-0 [RN]
boc-aph(hor)-oh
MFCD03094907

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.583
    Molar Refractivity: 103.4±0.3 cm3
    #H bond acceptors: 11
    #H bond donors: 5
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 0.82
    ACD/LogD (pH 5.5): -0.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.49
    ACD/LogD (pH 7.4): -2.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 163 Å2
    Polarizability: 41.0±0.5 10-24cm3
    Surface Tension: 60.2±3.0 dyne/cm
    Molar Volume: 309.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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