Found 134 results

Search term: MF = 'C_{32}H_{41}NO_{6}'
ChemSpider 2D Image | N-(4-Oxo-4-{[(17beta)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)phenylalanine | C32H41NO6

N-(4-Oxo-4-{[(17β)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)phenylalanine

  • Molecular FormulaC32H41NO6
  • Average mass535.671 Da
  • Monoisotopic mass535.293396 Da
  • ChemSpider ID17468247

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

N-(4-Oxo-4-{[(17β)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)phenylalanin [German] [ACD/IUPAC Name]
N-(4-Oxo-4-{[(17β)-3-oxoandrost-4-en-17-yl]oxy}butanoyl)phenylalanine [ACD/IUPAC Name]
N-(4-Oxo-4-{[(17β)-3-oxoandrost-4-én-17-yl]oxy}butanoyl)phénylalanine [French] [ACD/IUPAC Name]
Phenylalanine, N-[1,4-dioxo-4-[[(17β)-3-oxoandrost-4-en-17-yl]oxy]butyl]- [ACD/Index Name]
2-(4-(((8R,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)oxy)-4-oxobutanamido)-3-phenylpropanoic acid

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 743.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 113.7±3.0 kJ/mol
    Flash Point: 403.2±32.9 °C
    Index of Refraction: 1.589
    Molar Refractivity: 146.0±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.24
    ACD/LogD (pH 5.5): 2.26
    ACD/BCF (pH 5.5): 8.85
    ACD/KOC (pH 5.5): 37.69
    ACD/LogD (pH 7.4): 0.91
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.69
    Polar Surface Area: 110 Å2
    Polarizability: 57.9±0.5 10-24cm3
    Surface Tension: 55.1±5.0 dyne/cm
    Molar Volume: 433.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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