ChemSpider 2D Image | (6E)-5-Imino-3-phenyl-6-[(5-phenyl-2-furyl)methylene]-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one | C23H15N3O2S

(6E)-5-Imino-3-phenyl-6-[(5-phenyl-2-furyl)methylene]-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one

  • Molecular FormulaC23H15N3O2S
  • Average mass397.449 Da
  • Monoisotopic mass397.088501 Da
  • ChemSpider ID22845816

  • Double-bond stereo - Double-bond stereo

More details:

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

(6E)-5-Imino-3-phenyl-6-[(5-phenyl-2-furyl)methylen]-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-on [German] [ACD/IUPAC Name]
(6E)-5-Imino-3-phenyl-6-[(5-phenyl-2-furyl)methylene]-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one [ACD/IUPAC Name]
(6E)-5-Imino-3-phényl-6-[(5-phényl-2-furyl)méthylène]-5,6-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one [French] [ACD/IUPAC Name]
7H-Thiazolo[3,2-a]pyrimidin-7-one, 5,6-dihydro-5-imino-3-phenyl-6-[(5-phenyl-2-furanyl)methylene]-, (6E)- [ACD/Index Name]
(6E)-5-imino-3-phenyl-6-[(5-phenylfuran-2-yl)methylidene]-[1,3]thiazolo[3,2-a]pyrimidin-7-one
380548-47-0 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 584.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 87.4±3.0 kJ/mol
    Flash Point: 307.4±32.9 °C
    Index of Refraction: 1.720
    Molar Refractivity: 114.8±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: 5.61
    ACD/LogD (pH 5.5): 4.55
    ACD/BCF (pH 5.5): 1688.26
    ACD/KOC (pH 5.5): 7108.83
    ACD/LogD (pH 7.4): 4.55
    ACD/BCF (pH 7.4): 1688.26
    ACD/KOC (pH 7.4): 7108.83
    Polar Surface Area: 95 Å2
    Polarizability: 45.5±0.5 10-24cm3
    Surface Tension: 58.5±7.0 dyne/cm
    Molar Volume: 290.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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