ChemSpider 2D Image | N,N-Dibutyl-6-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(4-ethoxyphenyl)-4-pyrimidinamine | C29H47N5O

N,N-Dibutyl-6-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(4-ethoxyphenyl)-4-pyrimidinamine

  • Molecular FormulaC29H47N5O
  • Average mass481.716 Da
  • Monoisotopic mass481.378052 Da
  • ChemSpider ID121953845

More details:

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

4-Pyrimidinamine, N,N-dibutyl-6-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(4-ethoxyphenyl)- [ACD/Index Name]
N,N-Dibutyl-6-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(4-ethoxyphenyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
N,N-Dibutyl-6-[4-(2,2-dimethylpropyl)-1-piperazinyl]-2-(4-ethoxyphenyl)-4-pyrimidinamine [ACD/IUPAC Name]
N,N-Dibutyl-6-[4-(2,2-diméthylpropyl)-1-pipérazinyl]-2-(4-éthoxyphényl)-4-pyrimidinamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 556.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.1±30.1 °C
Index of Refraction: 1.541
Molar Refractivity: 147.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 7.75
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 16.75
ACD/KOC (pH 5.5): 24.85
ACD/LogD (pH 7.4): 5.70
ACD/BCF (pH 7.4): 7462.40
ACD/KOC (pH 7.4): 11068.96
Polar Surface Area: 45 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 469.2±3.0 cm3

Click to predict properties on the Chemicalize site


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