Found 130 results

Search term: MF = 'C_{29}H_{30}F_{3}N_{3}O_{2}'
ChemSpider 2D Image | N-(3-Methoxyphenyl)-3-(2-phenylethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide | C29H30F3N3O2

N-(3-Methoxyphenyl)-3-(2-phenylethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide

  • Molecular FormulaC29H30F3N3O2
  • Average mass509.563 Da
  • Monoisotopic mass509.229004 Da
  • ChemSpider ID22594317

More details:

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

1H-Pyrazino[1,2-a]quinoline-5-carboxamide, 2,3,4,4a,5,6-hexahydro-N-(3-methoxyphenyl)-3-(2-phenylethyl)-8-(trifluoromethyl)- [ACD/Index Name]
N-(3-Methoxyphenyl)-3-(2-phenylethyl)-8-(trifluormethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]chinolin-5-carboxamid [German] [ACD/IUPAC Name]
N-(3-Méthoxyphényl)-3-(2-phényléthyl)-8-(trifluorométhyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoléine-5-carboxamide [French] [ACD/IUPAC Name]
N-(3-Methoxyphenyl)-3-(2-phenylethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide [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: 657.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.2±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 136.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 4.65
ACD/BCF (pH 5.5): 945.08
ACD/KOC (pH 5.5): 1904.52
ACD/LogD (pH 7.4): 5.92
ACD/BCF (pH 7.4): 17450.31
ACD/KOC (pH 7.4): 35165.77
Polar Surface Area: 45 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 53.9±5.0 dyne/cm
Molar Volume: 388.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement