ChemSpider 2D Image | Ethyl 6-acetyl-2-{[4-(diallylsulfamoyl)benzoyl]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate | C25H29N3O6S2

Ethyl 6-acetyl-2-{[4-(diallylsulfamoyl)benzoyl]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate

  • Molecular FormulaC25H29N3O6S2
  • Average mass531.644 Da
  • Monoisotopic mass531.149780 Da
  • ChemSpider ID3336281

More details:

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

6-Acétyl-2-{[4-(diallylsulfamoyl)benzoyl]amino}-4,5,6,7-tétrahydrothiéno[2,3-c]pyridine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 6-acetyl-2-{[4-(diallylsulfamoyl)benzoyl]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate [ACD/IUPAC Name]
Ethyl-6-acetyl-2-{[4-(diallylsulfamoyl)benzoyl]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-carboxylat [German] [ACD/IUPAC Name]
Thieno[2,3-c]pyridine-3-carboxylic acid, 6-acetyl-2-[[4-[(di-2-propen-1-ylamino)sulfonyl]benzoyl]amino]-4,5,6,7-tetrahydro-, ethyl ester [ACD/Index Name]
449769-47-5 [RN]
ethyl 6-acetyl-2-(4-(N,N-diallylsulfamoyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
ethyl 6-acetyl-2-[[4-[bis(prop-2-enyl)sulfamoyl]benzoyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
ethyl 6-acetyl-2-{4-[bis(prop-2-en-1-yl)sulfamoyl]benzamido}-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-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: 1.605
    Molar Refractivity: 138.9±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 5.48
    ACD/LogD (pH 5.5): 4.44
    ACD/BCF (pH 5.5): 1391.54
    ACD/KOC (pH 5.5): 6190.31
    ACD/LogD (pH 7.4): 4.44
    ACD/BCF (pH 7.4): 1391.42
    ACD/KOC (pH 7.4): 6189.77
    Polar Surface Area: 150 Å2
    Polarizability: 55.0±0.5 10-24cm3
    Surface Tension: 55.8±3.0 dyne/cm
    Molar Volume: 403.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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