ChemSpider 2D Image | 4-(5,11-Dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide | C26H22N6O3

4-(5,11-Dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide

  • Molecular FormulaC26H22N6O3
  • Average mass466.491 Da
  • Monoisotopic mass466.175354 Da
  • ChemSpider ID32511465

More details:

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

4-(5,11-Dioxo-6a,11-dihydroisoindolo[2,1-a]chinazolin-6(5H)-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamid [German] [ACD/IUPAC Name]
4-(5,11-Dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide [ACD/IUPAC Name]
4-(5,11-Dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylméthyl)butanamide [French] [ACD/IUPAC Name]
Isoindolo[2,1-a]quinazoline-6(5H)-butanamide, 6a,11-dihydro-5,11-dioxo-N-(1,2,4-triazolo[4,3-a]pyridin-3-ylmethyl)- [ACD/Index Name]
1630847-21-0 [RN]
4-(5,11-dioxo-6aH-isoindolo[2,1-a]quinazolin-6-yl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)butanamide

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

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.759
    Molar Refractivity: 130.7±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.43
    ACD/LogD (pH 5.5): 1.63
    ACD/BCF (pH 5.5): 10.29
    ACD/KOC (pH 5.5): 184.43
    ACD/LogD (pH 7.4): 1.64
    ACD/BCF (pH 7.4): 10.32
    ACD/KOC (pH 7.4): 185.01
    Polar Surface Area: 100 Å2
    Polarizability: 51.8±0.5 10-24cm3
    Surface Tension: 66.6±7.0 dyne/cm
    Molar Volume: 317.9±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement