ChemSpider 2D Image | 4-(4-{[N-Acetyl-N-(2-methoxyethyl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide | C25H30F3N5O4

4-(4-{[N-Acetyl-N-(2-methoxyethyl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide

  • Molecular FormulaC25H30F3N5O4
  • Average mass521.532 Da
  • Monoisotopic mass521.224976 Da
  • ChemSpider ID22642310

More details:

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

1-Piperazinecarboxamide, 4-[4-[[2-[acetyl(2-methoxyethyl)amino]acetyl]amino]phenyl]-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-(4-{[N-Acetyl-N-(2-methoxyethyl)glycyl]amino}phenyl)-N-[3-(trifluormethyl)phenyl]-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-(4-{[N-Acetyl-N-(2-methoxyethyl)glycyl]amino}phenyl)-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide [ACD/IUPAC Name]
4-(4-{[N-Acétyl-N-(2-méthoxyéthyl)glycyl]amino}phényl)-N-[3-(trifluorométhyl)phényl]-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 744.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.5±3.0 kJ/mol
Flash Point: 403.8±32.9 °C
Index of Refraction: 1.588
Molar Refractivity: 131.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.09
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 32.80
ACD/KOC (pH 5.5): 416.34
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.75
ACD/KOC (pH 7.4): 441.12
Polar Surface Area: 94 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 54.0±3.0 dyne/cm
Molar Volume: 391.2±3.0 cm3

Click to predict properties on the Chemicalize site


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