ChemSpider 2D Image | 2-({[4-(2,3-Difluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoic acid | C20H16F2N4O3

2-({[4-(2,3-Difluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoic acid

  • Molecular FormulaC20H16F2N4O3
  • Average mass398.363 Da
  • Monoisotopic mass398.119049 Da
  • ChemSpider ID26045196

More details:

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

2-({[4-(2,3-Difluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoic acid [ACD/IUPAC Name]
2-({[4-(2,3-Difluorphenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoesäure [German] [ACD/IUPAC Name]
Acide 2-({[4-(2,3-difluorophényl)-1,4,6,7-tétrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[[4-(2,3-difluorophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl]amino]- [ACD/Index Name]
1219570-91-8 [RN]
2-[[4-(2,3-difluorophenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carbonyl]amino]benzoic acid
2-{[4-(2,3-Difluoro-phenyl)-1,4,6,7-tetrahydro-imidazo[4,5-c]pyridine-5-carbonyl]-amino}-benzoic acid

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 702.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 107.9±3.0 kJ/mol
    Flash Point: 378.5±32.9 °C
    Index of Refraction: 1.683
    Molar Refractivity: 99.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.68
    ACD/LogD (pH 5.5): 1.17
    ACD/BCF (pH 5.5): 1.34
    ACD/KOC (pH 5.5): 9.95
    ACD/LogD (pH 7.4): 0.44
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.84
    Polar Surface Area: 98 Å2
    Polarizability: 39.5±0.5 10-24cm3
    Surface Tension: 74.0±3.0 dyne/cm
    Molar Volume: 262.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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