ChemSpider 2D Image | Ethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-(2,7-naphthyridin-1-ylamino)-L-phenylalaninate | C24H28N4O4

Ethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-(2,7-naphthyridin-1-ylamino)-L-phenylalaninate

  • Molecular FormulaC24H28N4O4
  • Average mass436.504 Da
  • Monoisotopic mass436.211060 Da
  • ChemSpider ID29211823

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Ethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-(2,7-naphthyridin-1-ylamino)-L-phenylalaninate [ACD/IUPAC Name]
Ethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-(2,7-naphthyridin-1-ylamino)-L-phenylalaninat [German] [ACD/IUPAC Name]
L-Phenylalanine, N-[(1,1-dimethylethoxy)carbonyl]-4-(2,7-naphthyridin-1-ylamino)-, ethyl ester [ACD/Index Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-4-(2,7-naphtyridin-1-ylamino)-L-phénylalaninate d'éthyle [French] [ACD/IUPAC Name]
(s)-ethyl 3-(4-((2,7-naphthyridin-1-yl)amino)phenyl)-2-((tert-butoxycarbonyl)amino)propanoate
(S)-ethyl 3-(4-(2,7-naphthyridin-1-ylamino)phenyl)-2-(tert-butoxycarbonylamino)propanoate
(S)-ethyl-3-(4-(2,7-naphthyridin-1-ylamino)phenyl)-2-(tert-butoxycarbonylamino)propanoate
369648-62-4 [RN]
CS-14214
MFCD18207037

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 613.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.1±3.0 kJ/mol
    Flash Point: 325.1±31.5 °C
    Index of Refraction: 1.607
    Molar Refractivity: 123.3±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 3.98
    ACD/LogD (pH 5.5): 3.54
    ACD/BCF (pH 5.5): 264.48
    ACD/KOC (pH 5.5): 1713.15
    ACD/LogD (pH 7.4): 3.68
    ACD/BCF (pH 7.4): 369.02
    ACD/KOC (pH 7.4): 2390.31
    Polar Surface Area: 102 Å2
    Polarizability: 48.9±0.5 10-24cm3
    Surface Tension: 51.7±3.0 dyne/cm
    Molar Volume: 357.1±3.0 cm3

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