ChemSpider 2D Image | 8-(3,4-Dimethoxyphenyl)-9-phenyl-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one | C20H17N7O3

8-(3,4-Dimethoxyphenyl)-9-phenyl-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one

  • Molecular FormulaC20H17N7O3
  • Average mass403.394 Da
  • Monoisotopic mass403.139282 Da
  • ChemSpider ID29013965

More details:

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

8-(3,4-Dimethoxyphenyl)-9-phenyl-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-on [German] [ACD/IUPAC Name]
8-(3,4-Dimethoxyphenyl)-9-phenyl-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one [ACD/IUPAC Name]
8-(3,4-Diméthoxyphényl)-9-phényl-1,9-dihydrotétrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5(6H)-one [French] [ACD/IUPAC Name]
Tetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol, 8-(3,4-dimethoxyphenyl)-4,9-dihydro-9-phenyl- [ACD/Index Name]
8-(3,4-dimethoxyphenyl)-9-phenyl-1,9-dihydrotetrazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
8-(3,4-dimethoxyphenyl)-9-phenyl-2,9-dihydro-1H-tetrazolo[4,5]pyrimido[1,4-c]pyridazin-5-one
8-(3,4-dimethoxyphenyl)-9-phenyl-4,9-dihydrotetraazolo[1',5':1,2]pyrimido[4,5-d]pyridazin-5-ol
947096-21-1 [RN]
AGN-PC-08S8RN
AKOS004922881
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 623.8±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.8±3.0 kJ/mol
    Flash Point: 331.1±34.3 °C
    Index of Refraction: 1.768
    Molar Refractivity: 107.5±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 2.54
    ACD/LogD (pH 5.5): 0.26
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.29
    ACD/LogD (pH 7.4): 0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.72
    Polar Surface Area: 120 Å2
    Polarizability: 42.6±0.5 10-24cm3
    Surface Tension: 64.2±7.0 dyne/cm
    Molar Volume: 259.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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