ChemSpider 2D Image | Ethyl 3-(4-methylphenyl)-4-oxo-5-{[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate | C28H27N3O7S

Ethyl 3-(4-methylphenyl)-4-oxo-5-{[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate

  • Molecular FormulaC28H27N3O7S
  • Average mass549.595 Da
  • Monoisotopic mass549.156982 Da
  • ChemSpider ID4879123

  • Double-bond stereo - Double-bond stereo

More details:

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

3-(4-Méthylphényl)-4-oxo-5-{[(2E)-3-(3,4,5-triméthoxyphényl)-2-propenoyl]amino}-3,4-dihydrothiéno[3,4-d]pyridazine-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(4-methylphenyl)-4-oxo-5-{[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate [ACD/IUPAC Name]
Ethyl-3-(4-methylphenyl)-4-oxo-5-{[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}-3,4-dihydrothieno[3,4-d]pyridazin-1-carboxylat [German] [ACD/IUPAC Name]
Thieno[3,4-d]pyridazine-1-carboxylic acid, 3,4-dihydro-3-(4-methylphenyl)-4-oxo-5-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]amino]-, ethyl ester [ACD/Index Name]
(E)-ethyl 4-oxo-3-(p-tolyl)-5-(3-(3,4,5-trimethoxyphenyl)acrylamido)-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
851948-51-1 [RN]
ethyl (e)-4-oxo-3-(p-tolyl)-5-(3-(3,4,5-trimethoxyphenyl)acrylamido)-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
ethyl 3-(4-methylphenyl)-4-oxo-5-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enamido]-3H,4H-thieno[3,4-d]pyridazine-1-carboxylate
ethyl 3-(4-methylphenyl)-4-oxo-5-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]thieno[3,4-d]pyridazine-1-carboxylate

    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: 1.620
    Molar Refractivity: 146.5±0.5 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 4.74
    ACD/LogD (pH 5.5): 3.64
    ACD/BCF (pH 5.5): 345.53
    ACD/KOC (pH 5.5): 2283.79
    ACD/LogD (pH 7.4): 3.64
    ACD/BCF (pH 7.4): 345.44
    ACD/KOC (pH 7.4): 2283.15
    Polar Surface Area: 144 Å2
    Polarizability: 58.1±0.5 10-24cm3
    Surface Tension: 47.8±7.0 dyne/cm
    Molar Volume: 416.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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