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Search term: MBTCJFAQKYTMFO-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-[(4-Sulfamoylphenyl)amino]-1-{1-[2-(trifluoromethyl)phenyl]ethyl}-1H-benzimidazole-5-carboxamide | C23H20F3N5O3S

2-[(4-Sulfamoylphenyl)amino]-1-{1-[2-(trifluoromethyl)phenyl]ethyl}-1H-benzimidazole-5-carboxamide

  • Molecular FormulaC23H20F3N5O3S
  • Average mass503.497 Da
  • Monoisotopic mass503.123901 Da
  • ChemSpider ID24618980

More details:






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

1H-Benzimidazole-5-carboxamide, 2-[[4-(aminosulfonyl)phenyl]amino]-1-[1-[2-(trifluoromethyl)phenyl]ethyl]- [ACD/Index Name]
2-[(4-Sulfamoylphenyl)amino]-1-{1-[2-(trifluormethyl)phenyl]ethyl}-1H-benzimidazol-5-carboxamid [German] [ACD/IUPAC Name]
2-[(4-Sulfamoylphenyl)amino]-1-{1-[2-(trifluoromethyl)phenyl]ethyl}-1H-benzimidazole-5-carboxamide [ACD/IUPAC Name]
2-[(4-Sulfamoylphényl)amino]-1-{1-[2-(trifluorométhyl)phényl]éthyl}-1H-benzimidazole-5-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 734.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.2±3.0 kJ/mol
Flash Point: 398.0±35.7 °C
Index of Refraction: 1.659
Molar Refractivity: 122.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 118.06
ACD/KOC (pH 5.5): 1041.67
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 124.74
ACD/KOC (pH 7.4): 1100.69
Polar Surface Area: 141 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 332.9±7.0 cm3

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