ChemSpider 2D Image | 2-{1-[2-(Dimethylamino)ethyl]-3-(2-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl}-N-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-N-methylacetamide | C25H27F2N5O3

2-{1-[2-(Dimethylamino)ethyl]-3-(2-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl}-N-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-N-methylacetamide

  • Molecular FormulaC25H27F2N5O3
  • Average mass483.510 Da
  • Monoisotopic mass483.208191 Da
  • ChemSpider ID22166553

More details:

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

2-{1-[2-(Dimethylamino)ethyl]-3-(2-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl}-N-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-N-methylacetamide [ACD/IUPAC Name]
2-{1-[2-(Diméthylamino)éthyl]-3-(2-fluorophényl)-2,5-dioxo-3-pyrrolidinyl}-N-[(5-fluoro-1H-benzimidazol-2-yl)méthyl]-N-méthylacétamide [French] [ACD/IUPAC Name]
2-{1-[2-(Dimethylamino)ethyl]-3-(2-fluorphenyl)-2,5-dioxo-3-pyrrolidinyl}-N-[(5-fluor-1H-benzimidazol-2-yl)methyl]-N-methylacetamid [German] [ACD/IUPAC Name]
3-Pyrrolidineacetamide, 1-[2-(dimethylamino)ethyl]-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-3-(2-fluorophenyl)-N-methyl-2,5-dioxo- [ACD/Index Name]
2-[1-[2-(dimethylamino)ethyl]-3-(2-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-N-methylacetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 715.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.6±3.0 kJ/mol
Flash Point: 386.4±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 126.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): -0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 1.57
ACD/KOC (pH 7.4): 21.18
Polar Surface Area: 90 Å2
Polarizability: 50.0±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 363.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement