ChemSpider 2D Image | N-(2-Isobutyl-1H-benzimidazol-5-yl)-3-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide | C20H23N7O2

N-(2-Isobutyl-1H-benzimidazol-5-yl)-3-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide

  • Molecular FormulaC20H23N7O2
  • Average mass393.442 Da
  • Monoisotopic mass393.191315 Da
  • ChemSpider ID30670326

More details:

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

1,2,4-Triazolo[4,3-b]pyridazine-3-propanamide, 6-methoxy-N-[2-(2-methylpropyl)-1H-benzimidazol-5-yl]- [ACD/Index Name]
N-(2-Isobutyl-1H-benzimidazol-5-yl)-3-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamid [German] [ACD/IUPAC Name]
N-(2-Isobutyl-1H-benzimidazol-5-yl)-3-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide [ACD/IUPAC Name]
N-(2-Isobutyl-1H-benzimidazol-5-yl)-3-(6-méthoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)propanamide [French] [ACD/IUPAC Name]
1374526-80-3 [RN]
3-(6-methoxy[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2-methylpropyl)-1H-benzimidazol-6-yl]propanamide
3-(6-methoxy-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-[2-(2-methylpropyl)-3H-benzimidazol-5-yl]propanamide
AGN-PC-0DAYJE
MCULE-1302862094
MolPort-021-742-588
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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:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.701
    Molar Refractivity: 108.5±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 2.04
    ACD/LogD (pH 5.5): 1.51
    ACD/BCF (pH 5.5): 6.87
    ACD/KOC (pH 5.5): 110.30
    ACD/LogD (pH 7.4): 1.85
    ACD/BCF (pH 7.4): 14.99
    ACD/KOC (pH 7.4): 240.67
    Polar Surface Area: 110 Å2
    Polarizability: 43.0±0.5 10-24cm3
    Surface Tension: 54.5±7.0 dyne/cm
    Molar Volume: 280.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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