ChemSpider 2D Image | 3,5-Dichloro-3'-[(diethylamino)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4-biphenylsulfonamide | C23H28Cl2N4O2S

3,5-Dichloro-3'-[(diethylamino)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4-biphenylsulfonamide

  • Molecular FormulaC23H28Cl2N4O2S
  • Average mass495.465 Da
  • Monoisotopic mass494.131012 Da
  • ChemSpider ID26325397

More details:

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

[1,1'-Biphenyl]-4-sulfonamide, 3,5-dichloro-3'-[(diethylamino)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)- [ACD/Index Name]
3,5-Dichlor-3'-[(diethylamino)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4-biphenylsulfonamid [German] [ACD/IUPAC Name]
3,5-Dichloro-3'-[(diethylamino)methyl]-N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4-biphenylsulfonamide [ACD/IUPAC Name]
3,5-Dichloro-3'-[(diéthylamino)méthyl]-N-(1,3,5-triméthyl-1H-pyrazol-4-yl)-4-biphénylsulfonamide [French] [ACD/IUPAC Name]
3,5-Dichloro-3'-[(Diethylamino)methyl]-N-(1,3,5-Trimethyl-1h-Pyrazol-4-Yl)biphenyl-4-Sulfonamide
2CD

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

Density: 1.3±0.1 g/cm3
Boiling Point: 594.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.0±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 132.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 2.98
ACD/KOC (pH 5.5): 10.35
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 21.50
ACD/KOC (pH 7.4): 74.69
Polar Surface Area: 76 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 382.6±7.0 cm3

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