ChemSpider 2D Image | N-(1-Benzyl-4-piperidinyl)-2,6-dichloro-N-(2,3-dimethyl-1H-indol-7-yl)isonicotinamide | C28H28Cl2N4O

N-(1-Benzyl-4-piperidinyl)-2,6-dichloro-N-(2,3-dimethyl-1H-indol-7-yl)isonicotinamide

  • Molecular FormulaC28H28Cl2N4O
  • Average mass507.454 Da
  • Monoisotopic mass506.164032 Da
  • ChemSpider ID3341919

More details:






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

4-Pyridinecarboxamide, 2,6-dichloro-N-(2,3-dimethyl-1H-indol-7-yl)-N-[1-(phenylmethyl)-4-piperidinyl]- [ACD/Index Name]
N-(1-Benzyl-4-piperidinyl)-2,6-dichlor-N-(2,3-dimethyl-1H-indol-7-yl)isonicotinamid [German] [ACD/IUPAC Name]
N-(1-Benzyl-4-piperidinyl)-2,6-dichloro-N-(2,3-dimethyl-1H-indol-7-yl)isonicotinamide [ACD/IUPAC Name]
N-(1-Benzyl-4-pipéridinyl)-2,6-dichloro-N-(2,3-diméthyl-1H-indol-7-yl)isonicotinamide [French] [ACD/IUPAC Name]
N-(1-Benzylpiperidin-4-yl)-2,6-dichloro-N-(2,3-dimethyl-1H-indol-7-yl)pyridine-4-carboxamide

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

Peakdale1_002255 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 699.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 376.9±31.5 °C
Index of Refraction: 1.684
Molar Refractivity: 144.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 47.13
ACD/KOC (pH 5.5): 124.89
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 2347.83
ACD/KOC (pH 7.4): 6220.88
Polar Surface Area: 52 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 380.8±3.0 cm3

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