ChemSpider 2D Image | N-sec-Butyl-N-{[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-(2-thienyl)acetamide | C27H37N5OS

N-sec-Butyl-N-{[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-(2-thienyl)acetamide

  • Molecular FormulaC27H37N5OS
  • Average mass479.681 Da
  • Monoisotopic mass479.271881 Da
  • ChemSpider ID22742661

More details:

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

2-Thiopheneacetamide, N-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl]-N-(1-methylpropyl)- [ACD/Index Name]
N-sec-Butyl-N-{[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-(2-thienyl)acetamid [German] [ACD/IUPAC Name]
N-sec-Butyl-N-{[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-2-(2-thienyl)acetamide [ACD/IUPAC Name]
N-sec-Butyl-N-{[5-(4-éthyl-1-pipérazinyl)-3-méthyl-1-phényl-1H-pyrazol-4-yl]méthyl}-2-(2-thiényl)acétamide [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: 650.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 347.2±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 143.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 3.29
ACD/KOC (pH 5.5): 17.06
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 197.23
ACD/KOC (pH 7.4): 1022.26
Polar Surface Area: 73 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 408.9±7.0 cm3

Click to predict properties on the Chemicalize site


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