ChemSpider 2D Image | 11-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one | C31H32N2O5

11-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

  • Molecular FormulaC31H32N2O5
  • Average mass512.596 Da
  • Monoisotopic mass512.231140 Da
  • ChemSpider ID3189443

More details:

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

11-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-on [German] [ACD/IUPAC Name]
11-(3,4-Dimethoxyphenyl)-3-(4-methoxyphenyl)-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one [ACD/IUPAC Name]
11-(3,4-Diméthoxyphényl)-3-(4-méthoxyphényl)-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazépin-1-one [French] [ACD/IUPAC Name]
1H-Dibenzo[b,e][1,4]diazepin-1-one, 11-(3,4-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-3-(4-methoxyphenyl)-10-(1-oxopropyl)- [ACD/Index Name]
(6R,9S)-6-(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
11-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(3,4-Dimethoxy-phenyl)-3-(4-methoxy-phenyl)-10-propionyl-2,3,4,5,10,11-hexahydro-dibenzo[b,e][1,4]diazepin-1-one
354536-56-4 [RN]
6-(3,4-dimethoxyphenyl)-9-(4-methoxyphenyl)-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one
AC1N0VH2
More...

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

AK-968/14004855 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 718.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 105.0±3.0 kJ/mol
    Flash Point: 388.4±32.9 °C
    Index of Refraction: 1.641
    Molar Refractivity: 144.7±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 4.66
    ACD/LogD (pH 5.5): 4.93
    ACD/BCF (pH 5.5): 3271.44
    ACD/KOC (pH 5.5): 11413.94
    ACD/LogD (pH 7.4): 4.93
    ACD/BCF (pH 7.4): 3271.68
    ACD/KOC (pH 7.4): 11414.78
    Polar Surface Area: 77 Å2
    Polarizability: 57.3±0.5 10-24cm3
    Surface Tension: 58.3±5.0 dyne/cm
    Molar Volume: 401.1±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement