ChemSpider 2D Image | N-(6-{4-[3-(4-Methoxyphenyl)propyl]-1-piperazinyl}-2-[4-(2-methyl-2-propanyl)phenyl]-4-pyrimidinyl)-1H-indol-6-amine | C36H42N6O

N-(6-{4-[3-(4-Methoxyphenyl)propyl]-1-piperazinyl}-2-[4-(2-methyl-2-propanyl)phenyl]-4-pyrimidinyl)-1H-indol-6-amine

  • Molecular FormulaC36H42N6O
  • Average mass574.758 Da
  • Monoisotopic mass574.341980 Da
  • ChemSpider ID121543844

More details:

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

1H-Indol-6-amine, N-[2-[4-(1,1-dimethylethyl)phenyl]-6-[4-[3-(4-methoxyphenyl)propyl]-1-piperazinyl]-4-pyrimidinyl]- [ACD/Index Name]
N-(6-{4-[3-(4-Methoxyphenyl)propyl]-1-piperazinyl}-2-[4-(2-methyl-2-propanyl)phenyl]-4-pyrimidinyl)-1H-indol-6-amin [German] [ACD/IUPAC Name]
N-(6-{4-[3-(4-Methoxyphenyl)propyl]-1-piperazinyl}-2-[4-(2-methyl-2-propanyl)phenyl]-4-pyrimidinyl)-1H-indol-6-amine [ACD/IUPAC Name]
N-(6-{4-[3-(4-Méthoxyphényl)propyl]-1-pipérazinyl}-2-[4-(2-méthyl-2-propanyl)phényl]-4-pyrimidinyl)-1H-indol-6-amine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 710.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.9±3.0 kJ/mol
Flash Point: 383.6±32.9 °C
Index of Refraction: 1.640
Molar Refractivity: 176.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.68
ACD/LogD (pH 5.5): 3.70
ACD/BCF (pH 5.5): 78.03
ACD/KOC (pH 5.5): 120.76
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 20821.68
ACD/KOC (pH 7.4): 32222.14
Polar Surface Area: 69 Å2
Polarizability: 69.8±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 488.4±3.0 cm3

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