ChemSpider 2D Image | (2S)-N-(3,3-Diphenylpropyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide | C32H32N4O3

(2S)-N-(3,3-Diphenylpropyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide

  • Molecular FormulaC32H32N4O3
  • Average mass520.622 Da
  • Monoisotopic mass520.247437 Da
  • ChemSpider ID17465711

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-N-(3,3-Diphenylpropyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamid [German] [ACD/IUPAC Name]
(2S)-N-(3,3-Diphenylpropyl)-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide [ACD/IUPAC Name]
(2S)-N-(3,3-Diphénylpropyl)-2-[(11bS)-11b-méthyl-1,3-dioxo-5,6,11,11b-tétrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]propanamide [French] [ACD/IUPAC Name]
1H-Imidazo[1',5':1,2]pyrido[3,4-b]indole-2(3H)-acetamide, N-(3,3-diphenylpropyl)-5,6,11,11b-tetrahydro-α,11b-dimethyl-1,3-dioxo-, (αS,11bS)- [ACD/Index Name]
(S)-N-(3,3-diphenylpropyl)-2-((S)-11b-methyl-1,3-dioxo-5,6-dihydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H,11H,11bH)-yl)propanamide
956997-99-2 [RN]
MCULE-1597433941
MolPort-002-523-010
STOCK1N-48071
ZINC08918181

    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: 150.9±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 4.39
    ACD/LogD (pH 5.5): 4.73
    ACD/BCF (pH 5.5): 2308.08
    ACD/KOC (pH 5.5): 8892.25
    ACD/LogD (pH 7.4): 4.73
    ACD/BCF (pH 7.4): 2308.09
    ACD/KOC (pH 7.4): 8892.25
    Polar Surface Area: 86 Å2
    Polarizability: 59.8±0.5 10-24cm3
    Surface Tension: 68.5±5.0 dyne/cm
    Molar Volume: 391.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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