ChemSpider 2D Image | 3-Fluoro-4-(4-{[(2S)-2-(3-fluorophenyl)-1-pyrrolidinyl]methyl}phenoxy)benzamide | C24H22F2N2O2

3-Fluoro-4-(4-{[(2S)-2-(3-fluorophenyl)-1-pyrrolidinyl]methyl}phenoxy)benzamide

  • Molecular FormulaC24H22F2N2O2
  • Average mass408.440 Da
  • Monoisotopic mass408.164948 Da
  • ChemSpider ID28477759

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-Fluor-4-(4-{[(2S)-2-(3-fluorphenyl)-1-pyrrolidinyl]methyl}phenoxy)benzamid [German] [ACD/IUPAC Name]
3-Fluoro-4-(4-{[(2S)-2-(3-fluorophenyl)-1-pyrrolidinyl]methyl}phenoxy)benzamide [ACD/IUPAC Name]
3-Fluoro-4-(4-{[(2S)-2-(3-fluorophényl)-1-pyrrolidinyl]méthyl}phénoxy)benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-fluoro-4-[4-[[(2S)-2-(3-fluorophenyl)-1-pyrrolidinyl]methyl]phenoxy]- [ACD/Index Name]
(S)-3-Fluoro-4-(4-((2-(3-fluorophenyl)pyrrolidin-1-yl)methyl)phenoxy)benzamide
1346133-11-6 [RN]
3-Fluoro-4-[4-[[(2S)-2-(3-fluorophenyl)-1-pyrrolidinyl]methyl]phenoxy]benzamide
4-[4-[[(2S)-2-(3-Fluorophenyl)-1-pyrrolidinyl]methyl]phenoxy]-3-fluorobenzamide
FP3FBZ
LY 2444296
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 491.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 251.1±28.7 °C
Index of Refraction: 1.610
Molar Refractivity: 111.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 1.82
ACD/KOC (pH 5.5): 8.51
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 67.91
ACD/KOC (pH 7.4): 317.81
Polar Surface Area: 56 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 320.0±3.0 cm3

Click to predict properties on the Chemicalize site


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