ChemSpider 2D Image | Tert-Butyl [3-({[3-Tert-Butyl-1-(4-Methylphenyl)-1h-Pyrazol-5-Yl]carbamoyl}amino)propyl]carbamate | C23H35N5O3

Tert-Butyl [3-({[3-Tert-Butyl-1-(4-Methylphenyl)-1h-Pyrazol-5-Yl]carbamoyl}amino)propyl]carbamate

  • Molecular FormulaC23H35N5O3
  • Average mass429.556 Da
  • Monoisotopic mass429.273987 Da
  • ChemSpider ID35033447

More details:

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

[3-({[1-(4-Méthylphényl)-3-(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]carbamoyl}amino)propyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [3-({[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]carbamoyl}amino)propyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[3-({[1-(4-methylphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]carbamoyl}amino)propyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-[[[[3-(1,1-dimethylethyl)-1-(4-methylphenyl)-1H-pyrazol-5-yl]amino]carbonyl]amino]propyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
Tert-Butyl [3-({[3-Tert-Butyl-1-(4-Methylphenyl)-1h-Pyrazol-5-Yl]carbamoyl}amino)propyl]carbamate
0SO

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

Density: 1.1±0.1 g/cm3
Boiling Point: 559.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.1±30.1 °C
Index of Refraction: 1.556
Molar Refractivity: 122.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.25
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1249.57
ACD/KOC (pH 5.5): 5730.54
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1250.19
ACD/KOC (pH 7.4): 5733.39
Polar Surface Area: 97 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 39.3±7.0 dyne/cm
Molar Volume: 380.9±7.0 cm3

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