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Search term: GQLJDUKOOUYOQK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-Benzyl-3-(2,4-difluorophenyl)-N-[2-(dimethylamino)ethyl]-3-(1H-indol-3-yl)propanamide | C28H29F2N3O

N-Benzyl-3-(2,4-difluorophenyl)-N-[2-(dimethylamino)ethyl]-3-(1H-indol-3-yl)propanamide

  • Molecular FormulaC28H29F2N3O
  • Average mass461.546 Da
  • Monoisotopic mass461.227875 Da
  • ChemSpider ID21580183

More details:

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

1H-Indole-3-propanamide, β-(2,4-difluorophenyl)-N-[2-(dimethylamino)ethyl]-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-3-(2,4-difluorophenyl)-N-[2-(dimethylamino)ethyl]-3-(1H-indol-3-yl)propanamide [ACD/IUPAC Name]
N-Benzyl-3-(2,4-difluorophényl)-N-[2-(diméthylamino)éthyl]-3-(1H-indol-3-yl)propanamide [French] [ACD/IUPAC Name]
N-Benzyl-3-(2,4-difluorphenyl)-N-[2-(dimethylamino)ethyl]-3-(1H-indol-3-yl)propanamid [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 624.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.5±3.0 kJ/mol
Flash Point: 331.4±31.5 °C
Index of Refraction: 1.616
Molar Refractivity: 132.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 15.37
ACD/KOC (pH 5.5): 43.13
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 705.88
ACD/KOC (pH 7.4): 1980.88
Polar Surface Area: 39 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 378.3±3.0 cm3

Click to predict properties on the Chemicalize site


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