ChemSpider 2D Image | Ethyl 5-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate | C23H18BrN3O5S

Ethyl 5-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate

  • Molecular FormulaC23H18BrN3O5S
  • Average mass528.375 Da
  • Monoisotopic mass527.015076 Da
  • ChemSpider ID3629215

More details:

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

5-[(4-Bromobenzoyl)amino]-3-(4-méthoxyphényl)-4-oxo-3,4-dihydrothiéno[3,4-d]pyridazine-1-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate [ACD/IUPAC Name]
Ethyl-5-[(4-brombenzoyl)amino]-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazin-1-carboxylat [German] [ACD/IUPAC Name]
Thieno[3,4-d]pyridazine-1-carboxylic acid, 5-[(4-bromobenzoyl)amino]-3,4-dihydro-3-(4-methoxyphenyl)-4-oxo-, ethyl ester [ACD/Index Name]
851952-03-9 [RN]
ethyl 5-(4-bromobenzamido)-3-(4-methoxyphenyl)-4-oxo-3,4-dihydrothieno[3,4-d]pyridazine-1-carboxylate
ethyl 5-(4-bromobenzamido)-3-(4-methoxyphenyl)-4-oxo-3H,4H-thieno[3,4-d]pyridazine-1-carboxylate
ethyl 5-[(4-bromobenzoyl)amino]-3-(4-methoxyphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.685
    Molar Refractivity: 128.7±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 4.37
    ACD/BCF (pH 5.5): 1225.69
    ACD/KOC (pH 5.5): 5652.77
    ACD/LogD (pH 7.4): 4.37
    ACD/BCF (pH 7.4): 1225.49
    ACD/KOC (pH 7.4): 5651.83
    Polar Surface Area: 126 Å2
    Polarizability: 51.0±0.5 10-24cm3
    Surface Tension: 56.8±7.0 dyne/cm
    Molar Volume: 338.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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