ChemSpider 2D Image | 4-[(1-Benzyl-5-chloro-3-methyl-1H-pyrazol-4-yl)methyl]-N,N-dimethyl-1-piperazinecarboxamide | C19H26ClN5O

4-[(1-Benzyl-5-chloro-3-methyl-1H-pyrazol-4-yl)methyl]-N,N-dimethyl-1-piperazinecarboxamide

  • Molecular FormulaC19H26ClN5O
  • Average mass375.896 Da
  • Monoisotopic mass375.182587 Da
  • ChemSpider ID35208185

More details:

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

1-Piperazinecarboxamide, 4-[[5-chloro-3-methyl-1-(phenylmethyl)-1H-pyrazol-4-yl]methyl]-N,N-dimethyl- [ACD/Index Name]
4-[(1-Benzyl-5-chlor-3-methyl-1H-pyrazol-4-yl)methyl]-N,N-dimethyl-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-[(1-Benzyl-5-chloro-3-methyl-1H-pyrazol-4-yl)methyl]-N,N-dimethyl-1-piperazinecarboxamide [ACD/IUPAC Name]
4-[(1-Benzyl-5-chloro-3-méthyl-1H-pyrazol-4-yl)méthyl]-N,N-diméthyl-1-pipérazinecarboxamide [French] [ACD/IUPAC 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: 533.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 276.2±30.1 °C
Index of Refraction: 1.614
Molar Refractivity: 106.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 65.43
ACD/KOC (pH 5.5): 659.82
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.94
ACD/KOC (pH 7.4): 786.00
Polar Surface Area: 45 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 304.7±7.0 cm3

Click to predict properties on the Chemicalize site


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