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Search term: MF = 'C_{18}H_{18}N_{4}O_{3}'

ChemSpider 2D Image | 4-[4-(1H-Indol-4-yl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid | C18H18N4O3

4-[4-(1H-Indol-4-yl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid

  • Molecular FormulaC18H18N4O3
  • Average mass338.361 Da
  • Monoisotopic mass338.137878 Da
  • ChemSpider ID21858997

More details:






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

4-[4-(1H-Indol-4-yl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid [ACD/IUPAC Name]
4-[4-(1H-Indol-4-yl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutansäure [German] [ACD/IUPAC Name]
4-[4-(1H-Indol-4-yl)-3,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid
5H-Imidazo[4,5-c]pyridine-5-butanoic acid, 3,4,6,7-tetrahydro-4-(1H-indol-4-yl)-γ-oxo- [ACD/Index Name]
Acide 4-[4-(1H-indol-4-yl)-1,4,6,7-tétrahydro-5H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoïque [French] [ACD/IUPAC Name]
1071914-00-5 [RN]
4-(4-(1H-indol-4-yl)-6,7-dihydro-3H-imidazo[4,5-c]pyridin-5(4H)-yl)-4-oxobutanoic acid
4-[4-(1H-indol-4-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid
4-[4-(1H-Indol-4-yl)-3,4,6,7-tetrahydro-imidazo[4,5-c]pyridin-5-yl]-4-oxo-butyric acid
4-[4-(1H-indol-4-yl)-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridin-5-yl]-4-oxobutanoic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 766.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 117.0±3.0 kJ/mol
    Flash Point: 417.1±32.9 °C
    Index of Refraction: 1.707
    Molar Refractivity: 91.3±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): -0.85
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.50
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 102 Å2
    Polarizability: 36.2±0.5 10-24cm3
    Surface Tension: 80.2±3.0 dyne/cm
    Molar Volume: 234.4±3.0 cm3

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