ChemSpider 2D Image | [2-(3,4-DIMETHOXYPHENYL)ETHYL]({3-[4-(2-ISOPROPYL-1-METHYLINDOL-3-YLSULFONYL)PHENOXY]PROPYL})METHYLAMINE | C32H40N2O5S

[2-(3,4-DIMETHOXYPHENYL)ETHYL]({3-[4-(2-ISOPROPYL-1-METHYLINDOL-3-YLSULFONYL)PHENOXY]PROPYL})METHYLAMINE

  • Molecular FormulaC32H40N2O5S
  • Average mass564.735 Da
  • Monoisotopic mass564.265808 Da
  • ChemSpider ID114624

More details:

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

[2-(3,4-DIMETHOXYPHENYL)ETHYL]({3-[4-(2-ISOPROPYL-1-METHYLINDOL-3-YLSULFONYL)PHENOXY]PROPYL})METHYLAMINE
[2-(3,4-dimethoxyphenyl)ethyl](methyl)[3-(4-{[1-methyl-2-(propan-2-yl)-1H-indol-3-yl]sulfonyl}phenoxy)propyl]amine
121345-64-0 [RN]
Benzeneethanamine, 3,4-dimethoxy-N-methyl-N-[3-[4-[[1-methyl-2-(1-methylethyl)-1H-indol-3-yl]sulfonyl]phenoxy]propyl]- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{4-[(2-isopropyl-1-methyl-1H-indol-3-yl)sulfonyl]phenoxy}-N-methyl-1-propanamin [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-{4-[(2-isopropyl-1-methyl-1H-indol-3-yl)sulfonyl]phenoxy}-N-methyl-1-propanamine [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-3-{4-[(2-isopropyl-1-méthyl-1H-indol-3-yl)sulfonyl]phénoxy}-N-méthyl-1-propanamine [French] [ACD/IUPAC Name]
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-(4-{[1-methyl-2-(propan-2-yl)-1H-indol-3-yl]sulfonyl}phenoxy)propan-1-amine
[2-(3,4-Dimethoxy-phenyl)-ethyl]-{3-[4-(2-isopropyl-1-methyl-1H-indole-3-sulfonyl)-phenoxy]-propyl}-methyl-amine
3,4-Dimethoxy-N-methyl-N(3-(4-((1-methyl-2-(1-methylethyl)-1H-indol-3-yl)sulfonyl)phenoxy)propyl)benzeneethanamine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

SR 33805 [DBID]
SR-33805 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 724.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.8±3.0 kJ/mol
Flash Point: 391.7±32.9 °C
Index of Refraction: 1.571
Molar Refractivity: 160.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.01
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 14.78
ACD/KOC (pH 5.5): 36.00
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 436.22
ACD/KOC (pH 7.4): 1062.68
Polar Surface Area: 78 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 489.0±7.0 cm3

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