ChemSpider 2D Image | {6-Fluoro-4-[4-(2-methylphenyl)-1-piperazinyl]-3-quinolinyl}(1-pyrrolidinyl)methanone | C25H27FN4O

{6-Fluoro-4-[4-(2-methylphenyl)-1-piperazinyl]-3-quinolinyl}(1-pyrrolidinyl)methanone

  • Molecular FormulaC25H27FN4O
  • Average mass418.507 Da
  • Monoisotopic mass418.216888 Da
  • ChemSpider ID27310864

More details:

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

{6-Fluor-4-[4-(2-methylphenyl)-1-piperazinyl]-3-chinolinyl}(1-pyrrolidinyl)methanon [German] [ACD/IUPAC Name]
{6-Fluoro-4-[4-(2-méthylphényl)-1-pipérazinyl]-3-quinoléinyl}(1-pyrrolidinyl)méthanone [French] [ACD/IUPAC Name]
{6-Fluoro-4-[4-(2-methylphenyl)-1-piperazinyl]-3-quinolinyl}(1-pyrrolidinyl)methanone [ACD/IUPAC Name]
Methanone, [6-fluoro-4-[4-(2-methylphenyl)-1-piperazinyl]-3-quinolinyl]-1-pyrrolidinyl- [ACD/Index Name]
[6-Fluoro-4-(4-o-tolyl-piperazin-1-yl)-quinolin-3-yl]-pyrrolidin-1-yl-methanone
{6-fluoro-4-[4-(2-methylphenyl)piperazin-1-yl]quinolin-3-yl}(pyrrolidin-1-yl)methanone
1326913-21-6 [RN]
6-fluoro-4-[4-(2-methylphenyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)quinoline

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

Density: 1.3±0.1 g/cm3
Boiling Point: 630.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 334.8±31.5 °C
Index of Refraction: 1.647
Molar Refractivity: 120.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 1.12
ACD/KOC (pH 5.5): 7.77
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 50.53
ACD/KOC (pH 7.4): 351.94
Polar Surface Area: 40 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 332.1±3.0 cm3

Click to predict properties on the Chemicalize site


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