ChemSpider 2D Image | 2,4,6-Trimethyl-N-{4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl}-N-(phenylsulfonyl)benzenesulfonamide | C26H26N4O6S3

2,4,6-Trimethyl-N-{4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl}-N-(phenylsulfonyl)benzenesulfonamide

  • Molecular FormulaC26H26N4O6S3
  • Average mass586.703 Da
  • Monoisotopic mass586.101440 Da
  • ChemSpider ID102800150

More details:

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

2,4,6-Trimethyl-N-{4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl}-N-(phenylsulfonyl)benzenesulfonamide [ACD/IUPAC Name]
2,4,6-Triméthyl-N-{4-[(4-méthyl-2-pyrimidinyl)sulfamoyl]phényl}-N-(phénylsulfonyl)benzènesulfonamide [French] [ACD/IUPAC Name]
2,4,6-Trimethyl-N-{4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl}-N-(phenylsulfonyl)benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 2,4,6-trimethyl-N-[4-[[(4-methyl-2-pyrimidinyl)amino]sulfonyl]phenyl]-N-(phenylsulfonyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 792.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.3±3.0 kJ/mol
Flash Point: 433.2±35.7 °C
Index of Refraction: 1.652
Molar Refractivity: 149.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 3.79
ACD/BCF (pH 5.5): 407.10
ACD/KOC (pH 5.5): 2279.13
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 20.42
ACD/KOC (pH 7.4): 114.34
Polar Surface Area: 169 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 66.0±3.0 dyne/cm
Molar Volume: 407.4±3.0 cm3

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