ChemSpider 2D Image | 1-[4-amino-7-[3-(2-methoxyethylamino)propyl]-5-(4-methylphenyl)-6-pyrrolo[2,3-d]pyrimidinyl]-2-fluoroethanone | C21H26FN5O2

1-[4-amino-7-[3-(2-methoxyethylamino)propyl]-5-(4-methylphenyl)-6-pyrrolo[2,3-d]pyrimidinyl]-2-fluoroethanone

  • Molecular FormulaC21H26FN5O2
  • Average mass399.462 Da
  • Monoisotopic mass399.207062 Da
  • ChemSpider ID28659825

More details:

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

1-[4-amino-7-[3-(2-methoxyethylamino)propyl]-5-(4-methylphenyl)-6-pyrrolo[2,3-d]pyrimidinyl]-2-fluoroethanone
1-[4-amino-7-[3-(2-methoxyethylamino)propyl]-5-(4-methylphenyl)pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluoroethanone
1-[4-Amino-7-{3-[(2-methoxyethyl)amino]propyl}-5-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluorethanon [German] [ACD/IUPAC Name]
1-[4-Amino-7-{3-[(2-methoxyethyl)amino]propyl}-5-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluoroethanone [ACD/IUPAC Name]
1-[4-Amino-7-{3-[(2-méthoxyéthyl)amino]propyl}-5-(4-méthylphényl)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluoroéthanone [French] [ACD/IUPAC Name]
1414811-15-6 [RN]
BRD-K24859147-379-01-8
Ethanone, 1-[4-amino-7-[3-[(2-methoxyethyl)amino]propyl]-5-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]-2-fluoro- [ACD/Index Name]
fmk-mea

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 629.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 93.2±3.0 kJ/mol
    Flash Point: 334.7±31.5 °C
    Index of Refraction: 1.613
    Molar Refractivity: 108.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 1.45
    ACD/LogD (pH 5.5): -0.83
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.90
    ACD/BCF (pH 7.4): 1.53
    ACD/KOC (pH 7.4): 22.78
    Polar Surface Area: 95 Å2
    Polarizability: 43.0±0.5 10-24cm3
    Surface Tension: 46.0±7.0 dyne/cm
    Molar Volume: 311.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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