ChemSpider 2D Image | 7-(4-Ethoxyphenyl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine | C30H28N6O3

7-(4-Ethoxyphenyl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine

  • Molecular FormulaC30H28N6O3
  • Average mass520.582 Da
  • Monoisotopic mass520.222290 Da
  • ChemSpider ID2599388

More details:

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

7-(4-Ethoxyphenyl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin [German] [ACD/IUPAC Name]
7-(4-Ethoxyphenyl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine [ACD/IUPAC Name]
7-(4-Éthoxyphényl)-4-[4-(4-nitrophényl)-1-pipérazinyl]-5-phényl-7H-pyrrolo[2,3-d]pyrimidine [French] [ACD/IUPAC Name]
7H-Pyrrolo[2,3-d]pyrimidine, 7-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)-1-piperazinyl]-5-phenyl- [ACD/Index Name]
1-[7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-4-(4-nitrophenyl)piperazine
477242-04-9 [RN]
7-(4-ethoxyphenyl)-4-(4-(4-nitrophenyl)piperazin-1-yl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
7-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
7-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-5-phenylpyrrolo[2,3-d]pyrimidine

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 694.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.2 mmHg at 25°C
    Enthalpy of Vaporization: 101.7±3.0 kJ/mol
    Flash Point: 373.8±31.5 °C
    Index of Refraction: 1.683
    Molar Refractivity: 150.4±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 6.77
    ACD/LogD (pH 5.5): 4.72
    ACD/BCF (pH 5.5): 1340.72
    ACD/KOC (pH 5.5): 3238.13
    ACD/LogD (pH 7.4): 5.63
    ACD/BCF (pH 7.4): 10830.12
    ACD/KOC (pH 7.4): 26157.16
    Polar Surface Area: 92 Å2
    Polarizability: 59.6±0.5 10-24cm3
    Surface Tension: 55.7±7.0 dyne/cm
    Molar Volume: 396.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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