ChemSpider 2D Image | N-{6-[4-(1-Azepanyl)-1-piperidinyl]-2-(2-chlorophenyl)-4-pyrimidinyl}-1H-indol-6-amine | C29H33ClN6

N-{6-[4-(1-Azepanyl)-1-piperidinyl]-2-(2-chlorophenyl)-4-pyrimidinyl}-1H-indol-6-amine

  • Molecular FormulaC29H33ClN6
  • Average mass501.065 Da
  • Monoisotopic mass500.245514 Da
  • ChemSpider ID121480981

More details:

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

1H-Indol-6-amine, N-[2-(2-chlorophenyl)-6-[4-(hexahydro-1H-azepin-1-yl)-1-piperidinyl]-4-pyrimidinyl]- [ACD/Index Name]
N-{6-[4-(1-Azepanyl)-1-piperidinyl]-2-(2-chlorophenyl)-4-pyrimidinyl}-1H-indol-6-amine [ACD/IUPAC Name]
N-{6-[4-(1-Azépanyl)-1-pipéridinyl]-2-(2-chlorophényl)-4-pyrimidinyl}-1H-indol-6-amine [French] [ACD/IUPAC Name]
N-{6-[4-(1-Azepanyl)-1-piperidinyl]-2-(2-chlorphenyl)-4-pyrimidinyl}-1H-indol-6-amin [German] [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: 649.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 346.9±31.5 °C
Index of Refraction: 1.676
Molar Refractivity: 147.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.87
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 2.00
ACD/KOC (pH 5.5): 5.51
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 181.01
ACD/KOC (pH 7.4): 500.02
Polar Surface Area: 60 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 392.8±3.0 cm3

Click to predict properties on the Chemicalize site


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