ChemSpider 2D Image | (4-Methyl-1-piperazinyl){5-[(4-{4-[(1,1,1-trifluoro-2-propanyl)oxy]-2-pyridinyl}-2-pyrimidinyl)amino]-1H-indol-2-yl}methanone | C26H26F3N7O2

(4-Methyl-1-piperazinyl){5-[(4-{4-[(1,1,1-trifluoro-2-propanyl)oxy]-2-pyridinyl}-2-pyrimidinyl)amino]-1H-indol-2-yl}methanone

  • Molecular FormulaC26H26F3N7O2
  • Average mass525.526 Da
  • Monoisotopic mass525.210022 Da
  • ChemSpider ID58901523

More details:

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

(4-Methyl-1-piperazinyl){5-[(4-{4-[(1,1,1-trifluor-2-propanyl)oxy]-2-pyridinyl}-2-pyrimidinyl)amino]-1H-indol-2-yl}methanon [German] [ACD/IUPAC Name]
(4-Methyl-1-piperazinyl){5-[(4-{4-[(1,1,1-trifluoro-2-propanyl)oxy]-2-pyridinyl}-2-pyrimidinyl)amino]-1H-indol-2-yl}methanone [ACD/IUPAC Name]
(4-Méthyl-1-pipérazinyl){5-[(4-{4-[(1,1,1-trifluoro-2-propanyl)oxy]-2-pyridinyl}-2-pyrimidinyl)amino]-1H-indol-2-yl}méthanone [French] [ACD/IUPAC Name]
Methanone, (4-methyl-1-piperazinyl)[5-[[4-[4-(2,2,2-trifluoro-1-methylethoxy)-2-pyridinyl]-2-pyrimidinyl]amino]-1H-indol-2-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 714.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 386.0±35.7 °C
Index of Refraction: 1.634
Molar Refractivity: 136.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.45
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 2.17
ACD/KOC (pH 5.5): 23.56
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 44.88
ACD/KOC (pH 7.4): 487.10
Polar Surface Area: 99 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 382.8±3.0 cm3

Click to predict properties on the Chemicalize site


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