ChemSpider 2D Image | 1-Methyl-N-{2-oxo-1-phenyl-2-[(2-phenylethyl)amino]ethyl}-5-({[4-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)-1H-indole-2-carboxamide | C40H33F3N4O3

1-Methyl-N-{2-oxo-1-phenyl-2-[(2-phenylethyl)amino]ethyl}-5-({[4-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)-1H-indole-2-carboxamide

  • Molecular FormulaC40H33F3N4O3
  • Average mass674.710 Da
  • Monoisotopic mass674.250488 Da
  • ChemSpider ID28565784

More details:

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

1H-Indole-2-carboxamide, 1-methyl-N-[2-oxo-1-phenyl-2-[(2-phenylethyl)amino]ethyl]-5-[[[4-(trifluoromethyl)[1,1'-biphenyl]-2-yl]carbonyl]amino]- [ACD/Index Name]
1-Methyl-N-{2-oxo-1-phenyl-2-[(2-phenylethyl)amino]ethyl}-5-({[4-(trifluormethyl)-2-biphenylyl]carbonyl}amino)-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
1-Methyl-N-{2-oxo-1-phenyl-2-[(2-phenylethyl)amino]ethyl}-5-({[4-(trifluoromethyl)-2-biphenylyl]carbonyl}amino)-1H-indole-2-carboxamide [ACD/IUPAC Name]
1-Méthyl-N-{2-oxo-1-phényl-2-[(2-phényléthyl)amino]éthyl}-5-({[4-(trifluorométhyl)-2-biphénylyl]carbonyl}amino)-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]
N-((1S)-2-(BENZYLMETHYLAMINO)-2-OXO-1-PHENYLETHYL)-1-METHYL-5-(((4-(TRIFLUOROMETHYL)BIPHENYL-2-YL)CARBONYL)AMINO)-1H-INDOLE-2-CARBOXAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 862.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.3±3.0 kJ/mol
Flash Point: 475.1±34.3 °C
Index of Refraction: 1.619
Molar Refractivity: 187.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.59
ACD/LogD (pH 5.5): 6.98
ACD/BCF (pH 5.5): 118953.96
ACD/KOC (pH 5.5): 149463.22
ACD/LogD (pH 7.4): 6.98
ACD/BCF (pH 7.4): 118952.39
ACD/KOC (pH 7.4): 149461.25
Polar Surface Area: 92 Å2
Polarizability: 74.2±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 533.8±7.0 cm3

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