ChemSpider 2D Image | N-[2-{[Benzyl(methyl)amino]methyl}-3-(4-fluoro-2-methoxyphenyl)-5-isopropyl-1H-indol-7-yl]methanesulfonamide | C28H32FN3O3S

N-[2-{[Benzyl(methyl)amino]methyl}-3-(4-fluoro-2-methoxyphenyl)-5-isopropyl-1H-indol-7-yl]methanesulfonamide

  • Molecular FormulaC28H32FN3O3S
  • Average mass509.635 Da
  • Monoisotopic mass509.214844 Da
  • ChemSpider ID35034774

More details:






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

Methanesulfonamide, N-[3-(4-fluoro-2-methoxyphenyl)-5-(1-methylethyl)-2-[[methyl(phenylmethyl)amino]methyl]-1H-indol-7-yl]- [ACD/Index Name]
N-[2-{[Benzyl(methyl)amino]methyl}-3-(4-fluor-2-methoxyphenyl)-5-isopropyl-1H-indol-7-yl]methansulfonamid [German] [ACD/IUPAC Name]
N-[2-{[benzyl(Methyl)amino]methyl}-3-(4-Fluoro-2-Methoxyphenyl)-5-(Propan-2-Yl)-1h-Indol-7-Yl]methanesulfonamide
N-[2-{[Benzyl(methyl)amino]methyl}-3-(4-fluoro-2-methoxyphenyl)-5-isopropyl-1H-indol-7-yl]methanesulfonamide [ACD/IUPAC Name]
N-[2-{[Benzyl(méthyl)amino]méthyl}-3-(4-fluoro-2-méthoxyphényl)-5-isopropyl-1H-indol-7-yl]méthanesulfonamide [French] [ACD/IUPAC Name]
29M

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

Density: 1.3±0.1 g/cm3
Boiling Point: 627.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.8±3.0 kJ/mol
Flash Point: 333.0±34.3 °C
Index of Refraction: 1.627
Molar Refractivity: 142.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.25
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 23.93
ACD/KOC (pH 5.5): 64.11
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1187.72
ACD/KOC (pH 7.4): 3181.47
Polar Surface Area: 83 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 51.3±3.0 dyne/cm
Molar Volume: 403.2±3.0 cm3

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