ChemSpider 2D Image | Diethyl 2-[(4-benzoylbenzoyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate | C27H26N2O6S

Diethyl 2-[(4-benzoylbenzoyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate

  • Molecular FormulaC27H26N2O6S
  • Average mass506.570 Da
  • Monoisotopic mass506.151154 Da
  • ChemSpider ID3411176

More details:

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

2-[(4-Benzoylbenzoyl)amino]-4,7-dihydrothiéno[2,3-c]pyridine-3,6(5H)-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 2-[(4-benzoylbenzoyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate [ACD/IUPAC Name]
Diethyl-2-[(4-benzoylbenzoyl)amino]-4,7-dihydrothieno[2,3-c]pyridin-3,6(5H)-dicarboxylat [German] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-3,6(5H)-dicarboxylic acid, 2-[(4-benzoylbenzoyl)amino]-4,7-dihydro-, diethyl ester [ACD/Index Name]
3,6-diethyl 2-(4-benzoylbenzamido)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3,6-dicarboxylate
864926-47-6 [RN]
diethyl 2-(4-benzoylbenzamido)-4,5-dihydrothieno[2,3-c]pyridine-3,6(7H)-dicarboxylate
diethyl 2-(4-benzoylbenzamido)-4,7-dihydrothieno[2,3-c]pyridine-3,6(5h)-dicarboxylate
diethyl 2-[(4-benzoylbenzoyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3,6-dicarboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 637.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 94.1±3.0 kJ/mol
    Flash Point: 339.1±31.5 °C
    Index of Refraction: 1.634
    Molar Refractivity: 136.7±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.98
    ACD/LogD (pH 5.5): 5.22
    ACD/BCF (pH 5.5): 5437.58
    ACD/KOC (pH 5.5): 16420.86
    ACD/LogD (pH 7.4): 5.22
    ACD/BCF (pH 7.4): 5437.38
    ACD/KOC (pH 7.4): 16420.25
    Polar Surface Area: 130 Å2
    Polarizability: 54.2±0.5 10-24cm3
    Surface Tension: 58.3±3.0 dyne/cm
    Molar Volume: 382.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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