ChemSpider 2D Image | 2-{(2,6-Dichlorobenzyl)[N-(dimethylsulfamoyl)-N-(4-fluorophenyl)glycyl]amino}-N-isopropylbutanamide | C24H31Cl2FN4O4S

2-{(2,6-Dichlorobenzyl)[N-(dimethylsulfamoyl)-N-(4-fluorophenyl)glycyl]amino}-N-isopropylbutanamide

  • Molecular FormulaC24H31Cl2FN4O4S
  • Average mass561.497 Da
  • Monoisotopic mass560.142700 Da
  • ChemSpider ID68318087

More details:

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

2-{(2,6-Dichlorbenzyl)[N-(dimethylsulfamoyl)-N-(4-fluorphenyl)glycyl]amino}-N-isopropylbutanamid [German] [ACD/IUPAC Name]
2-{(2,6-Dichlorobenzyl)[N-(dimethylsulfamoyl)-N-(4-fluorophenyl)glycyl]amino}-N-isopropylbutanamide [ACD/IUPAC Name]
2-{(2,6-Dichlorobenzyl)[N-(diméthylsulfamoyl)-N-(4-fluorophényl)glycyl]amino}-N-isopropylbutanamide [French] [ACD/IUPAC Name]
Butanamide, 2-[[(2,6-dichlorophenyl)methyl][2-[[(dimethylamino)sulfonyl](4-fluorophenyl)amino]acetyl]amino]-N-(1-methylethyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 720.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.3±3.0 kJ/mol
Flash Point: 389.7±32.9 °C
Index of Refraction: 1.586
Molar Refractivity: 141.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 522.96
ACD/KOC (pH 5.5): 3072.42
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 522.96
ACD/KOC (pH 7.4): 3072.42
Polar Surface Area: 98 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 420.7±3.0 cm3

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