ChemSpider 2D Image | N-[4-Chloro-2-methoxy-5-(trifluoromethyl)phenyl]-1-methyl-7-{[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy}-1H-indole-2-carboxamide | C27H26ClF3N6O3

N-[4-Chloro-2-methoxy-5-(trifluoromethyl)phenyl]-1-methyl-7-{[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy}-1H-indole-2-carboxamide

  • Molecular FormulaC27H26ClF3N6O3
  • Average mass574.982 Da
  • Monoisotopic mass574.170715 Da
  • ChemSpider ID8229425

More details:






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

1H-Indole-2-carboxamide, N-[4-chloro-2-methoxy-5-(trifluoromethyl)phenyl]-1-methyl-7-[[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy]- [ACD/Index Name]
N-[4-Chlor-2-methoxy-5-(trifluormethyl)phenyl]-1-methyl-7-{[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy}-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]
N-[4-Chloro-2-methoxy-5-(trifluoromethyl)phenyl]-1-methyl-7-{[2-(4-methyl-1-piperazinyl)-4-pyrimidinyl]oxy}-1H-indole-2-carboxamide [ACD/IUPAC Name]
N-[4-Chloro-2-méthoxy-5-(trifluorométhyl)phényl]-1-méthyl-7-{[2-(4-méthyl-1-pipérazinyl)-4-pyrimidinyl]oxy}-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.631
Molar Refractivity: 143.1±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.32
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 532.81
ACD/KOC (pH 5.5): 1177.95
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 12582.27
ACD/KOC (pH 7.4): 27817.12
Polar Surface Area: 85 Å2
Polarizability: 56.7±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 401.4±7.0 cm3

Click to predict properties on the Chemicalize site






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