ChemSpider 2D Image | N-Isopropyl-2-[(11aS)-5-(4-isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide | C32H32N4O3

N-Isopropyl-2-[(11aS)-5-(4-isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID17469979

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Benzamide, N-(1-methylethyl)-2-[(11aS)-5,6,11,11a-tetrahydro-5-[4-(1-methylethyl)phenyl]-1,3-dioxo-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]- [ACD/Index Name]
N-Isopropyl-2-[(11aS)-5-(4-isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamid [German] [ACD/IUPAC Name]
N-Isopropyl-2-[(11aS)-5-(4-isopropylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide [ACD/IUPAC Name]
N-Isopropyl-2-[(11aS)-5-(4-isopropylphényl)-1,3-dioxo-5,6,11,11a-tétrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzamide [French] [ACD/IUPAC Name]
956967-56-9 [RN]
MCULE-9538785417
MolPort-002-532-018
N-isopropyl-2-((11aS)-5-(4-isopropylphenyl)-1,3-dioxo-11,11a-dihydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H,5H,6H)-yl)benzamide
STOCK1N-62146

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.697
    Molar Refractivity: 150.8±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 4.50
    ACD/LogD (pH 5.5): 4.73
    ACD/BCF (pH 5.5): 2303.80
    ACD/KOC (pH 5.5): 8880.43
    ACD/LogD (pH 7.4): 4.73
    ACD/BCF (pH 7.4): 2303.80
    ACD/KOC (pH 7.4): 8880.43
    Polar Surface Area: 86 Å2
    Polarizability: 59.8±0.5 10-24cm3
    Surface Tension: 67.6±5.0 dyne/cm
    Molar Volume: 391.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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