ChemSpider 2D Image | 1-[(3,5-Dimethoxyphenyl)amino]-3-(2-methyl-3-{1-[(4-methylphenyl)sulfonyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indol-1-yl)-2-propanol | C32H37N3O5S

1-[(3,5-Dimethoxyphenyl)amino]-3-(2-methyl-3-{1-[(4-methylphenyl)sulfonyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indol-1-yl)-2-propanol

  • Molecular FormulaC32H37N3O5S
  • Average mass575.718 Da
  • Monoisotopic mass575.245361 Da
  • ChemSpider ID21471844

More details:

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

1-[(3,5-Dimethoxyphenyl)amino]-3-(2-methyl-3-{1-[(4-methylphenyl)sulfonyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indol-1-yl)-2-propanol [ACD/IUPAC Name]
1-[(3,5-Dimethoxyphenyl)amino]-3-(2-methyl-3-{1-[(4-methylphenyl)sulfonyl]-1,2,3,6-tetrahydro-4-pyridinyl}-1H-indol-1-yl)-2-propanol [German] [ACD/IUPAC Name]
1-[(3,5-Diméthoxyphényl)amino]-3-(2-méthyl-3-{1-[(4-méthylphényl)sulfonyl]-1,2,3,6-tétrahydro-4-pyridinyl}-1H-indol-1-yl)-2-propanol [French] [ACD/IUPAC Name]
1H-Indole-1-ethanol, α-[[(3,5-dimethoxyphenyl)amino]methyl]-2-methyl-3-[1,2,3,6-tetrahydro-1-[(4-methylphenyl)sulfonyl]-4-pyridinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 805.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.8±3.0 kJ/mol
Flash Point: 440.8±37.1 °C
Index of Refraction: 1.621
Molar Refractivity: 160.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.29
ACD/LogD (pH 5.5): 5.08
ACD/BCF (pH 5.5): 4253.56
ACD/KOC (pH 5.5): 13708.61
ACD/LogD (pH 7.4): 5.09
ACD/BCF (pH 7.4): 4324.26
ACD/KOC (pH 7.4): 13936.48
Polar Surface Area: 101 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 47.1±7.0 dyne/cm
Molar Volume: 457.6±7.0 cm3

Click to predict properties on the Chemicalize site


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