ChemSpider 2D Image | 2-Methyl-2-propanyl (3-oxo-3-{[1-oxo-1-(4-propyl-1-piperazinyl)-2-hexanyl]amino}propyl)(3-pyridinylmethyl)carbamate | C27H45N5O4

2-Methyl-2-propanyl (3-oxo-3-{[1-oxo-1-(4-propyl-1-piperazinyl)-2-hexanyl]amino}propyl)(3-pyridinylmethyl)carbamate

  • Molecular FormulaC27H45N5O4
  • Average mass503.677 Da
  • Monoisotopic mass503.347168 Da
  • ChemSpider ID121771400

More details:

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

(3-Oxo-3-{[1-oxo-1-(4-propyl-1-pipérazinyl)-2-hexanyl]amino}propyl)(3-pyridinylméthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (3-oxo-3-{[1-oxo-1-(4-propyl-1-piperazinyl)-2-hexanyl]amino}propyl)(3-pyridinylmethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3-oxo-3-{[1-oxo-1-(4-propyl-1-piperazinyl)-2-hexanyl]amino}propyl)(3-pyridinylmethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-oxo-3-[[1-[(4-propyl-1-piperazinyl)carbonyl]pentyl]amino]propyl]-N-(3-pyridinylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 685.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.1±31.5 °C
Index of Refraction: 1.524
Molar Refractivity: 140.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 10.84
ACD/KOC (pH 5.5): 91.82
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 126.70
ACD/KOC (pH 7.4): 1073.08
Polar Surface Area: 95 Å2
Polarizability: 55.7±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 459.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement