ChemSpider 2D Image | 2-Methyl-2-propanyl (1-{1-[6-(4-methyl-3-oxo-1-piperazinyl)-4-pyrimidinyl]-3-piperidinyl}ethyl)carbamate | C21H34N6O3

2-Methyl-2-propanyl (1-{1-[6-(4-methyl-3-oxo-1-piperazinyl)-4-pyrimidinyl]-3-piperidinyl}ethyl)carbamate

  • Molecular FormulaC21H34N6O3
  • Average mass418.533 Da
  • Monoisotopic mass418.269226 Da
  • ChemSpider ID65092415

More details:

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

(1-{1-[6-(4-Méthyl-3-oxo-1-pipérazinyl)-4-pyrimidinyl]-3-pipéridinyl}éthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (1-{1-[6-(4-methyl-3-oxo-1-piperazinyl)-4-pyrimidinyl]-3-piperidinyl}ethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1-{1-[6-(4-methyl-3-oxo-1-piperazinyl)-4-pyrimidinyl]-3-piperidinyl}ethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[1-[6-(4-methyl-3-oxo-1-piperazinyl)-4-pyrimidinyl]-3-piperidinyl]ethyl]-, 1,1-dimethylethyl ester [ACD/Index 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: 643.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 342.8±31.5 °C
Index of Refraction: 1.547
Molar Refractivity: 113.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.39
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.10
Polar Surface Area: 91 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 358.5±3.0 cm3

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