ChemSpider 2D Image | N-Isopropyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzamide | C29H32F3N5O3

N-Isopropyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzamide

  • Molecular FormulaC29H32F3N5O3
  • Average mass555.591 Da
  • Monoisotopic mass555.245728 Da
  • ChemSpider ID909060

More details:

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

Benzamide, 2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(1-methylethyl)-5-[[[[3-(trifluoromethyl)phenyl]amino]carbonyl]amino]- [ACD/Index Name]
N-Isopropyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-({[3-(trifluormethyl)phenyl]carbamoyl}amino)benzamid [German] [ACD/IUPAC Name]
N-Isopropyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzamide [ACD/IUPAC Name]
N-Isopropyl-2-[4-(2-méthoxyphényl)-1-pipérazinyl]-5-({[3-(trifluorométhyl)phényl]carbamoyl}amino)benzamide [French] [ACD/IUPAC 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: 613.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 325.0±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 147.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 3.62
ACD/BCF (pH 5.5): 181.96
ACD/KOC (pH 5.5): 702.71
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 1988.70
ACD/KOC (pH 7.4): 7680.29
Polar Surface Area: 86 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 428.6±3.0 cm3

Click to predict properties on the Chemicalize site


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