ChemSpider 2D Image | 4-(Diisobutylsulfamoyl)-N-[(2E)-3-methylnaphtho[2,1-d][1,3]thiazol-2(3H)-ylidene]benzamide | C27H31N3O3S2

4-(Diisobutylsulfamoyl)-N-[(2E)-3-methylnaphtho[2,1-d][1,3]thiazol-2(3H)-ylidene]benzamide

  • Molecular FormulaC27H31N3O3S2
  • Average mass509.683 Da
  • Monoisotopic mass509.180695 Da
  • ChemSpider ID18377206

  • Double-bond stereo - Double-bond stereo

More details:

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

4-(Diisobutylsulfamoyl)-N-[(2E)-3-methylnaphtho[2,1-d][1,3]thiazol-2(3H)-yliden]benzamid [German] [ACD/IUPAC Name]
4-(Diisobutylsulfamoyl)-N-[(2E)-3-methylnaphtho[2,1-d][1,3]thiazol-2(3H)-ylidene]benzamide [ACD/IUPAC Name]
4-(Diisobutylsulfamoyl)-N-[(2E)-3-méthylnaphto[2,1-d][1,3]thiazol-2(3H)-ylidène]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[[bis(2-methylpropyl)amino]sulfonyl]-N-[(2E)-3-methylnaphtho[2,1-d]thiazol-2(3H)-ylidene]- [ACD/Index Name]
(E)-4-(N,N-diisobutylsulfamoyl)-N-(3-methylnaphtho[2,1-d]thiazol-2(3H)-ylidene)benzamide
4-[bis(2-methylpropyl)sulfamoyl]-N-[(2E)-3-methyl-2H,3H-naphtho[2,1-d][1,3]thiazol-2-ylidene]benzamide
477504-47-5 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 669.1±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 98.3±3.0 kJ/mol
    Flash Point: 358.4±34.3 °C
    Index of Refraction: 1.633
    Molar Refractivity: 145.2±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 7.13
    ACD/LogD (pH 5.5): 6.04
    ACD/BCF (pH 5.5): 22912.96
    ACD/KOC (pH 5.5): 45976.07
    ACD/LogD (pH 7.4): 6.04
    ACD/BCF (pH 7.4): 22912.96
    ACD/KOC (pH 7.4): 45976.07
    Polar Surface Area: 104 Å2
    Polarizability: 57.6±0.5 10-24cm3
    Surface Tension: 46.9±7.0 dyne/cm
    Molar Volume: 406.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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