ChemSpider 2D Image | N-[(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[2-oxo-2-(5-quinolinylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide | C22H23N7O3

N-[(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[2-oxo-2-(5-quinolinylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide

  • Molecular FormulaC22H23N7O3
  • Average mass433.463 Da
  • Monoisotopic mass433.186249 Da
  • ChemSpider ID26037082

More details:

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

1,2,4-Oxadiazole-3-acetamide, 5-[[[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino]carbonyl]-N-5-quinolinyl- [ACD/Index Name]
3-[2-(5-Chinolinylamino)-2-oxoethyl]-N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1,2,4-oxadiazol-5-carboxamid [German] [ACD/IUPAC Name]
N-[(1-Éthyl-3,5-diméthyl-1H-pyrazol-4-yl)méthyl]-3-[2-oxo-2-(5-quinoléinylamino)éthyl]-1,2,4-oxadiazole-5-carboxamide [French] [ACD/IUPAC Name]
N-[(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[2-oxo-2-(5-quinolinylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide [ACD/IUPAC Name]
1219581-08-4 [RN]
3-(Quinolin-5-ylcarbamoylmethyl)-[1,2,4]oxadiazole-5-carboxylic acid (1-ethyl-3,5-dimethyl-1H-pyrazol-4-ylmethyl)-amide
N-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[2-oxo-2-(quinolin-5-ylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-3-[2-oxo-2-(quinolin-5-ylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.691
    Molar Refractivity: 118.6±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 1.02
    ACD/LogD (pH 5.5): 1.56
    ACD/BCF (pH 5.5): 8.86
    ACD/KOC (pH 5.5): 162.72
    ACD/LogD (pH 7.4): 1.59
    ACD/BCF (pH 7.4): 9.46
    ACD/KOC (pH 7.4): 173.77
    Polar Surface Area: 128 Å2
    Polarizability: 47.0±0.5 10-24cm3
    Surface Tension: 55.4±7.0 dyne/cm
    Molar Volume: 309.9±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement