ChemSpider 2D Image | (1-{[1-(2-Methylbenzyl)-1H-indol-2-yl]methyl}-4-piperidinyl)(4-methyl-1-piperidinyl)methanone | C29H37N3O

(1-{[1-(2-Methylbenzyl)-1H-indol-2-yl]methyl}-4-piperidinyl)(4-methyl-1-piperidinyl)methanone

  • Molecular FormulaC29H37N3O
  • Average mass443.624 Da
  • Monoisotopic mass443.293671 Da
  • ChemSpider ID28315364

More details:

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

(1-{[1-(2-Methylbenzyl)-1H-indol-2-yl]methyl}-4-piperidinyl)(4-methyl-1-piperidinyl)methanon [German] [ACD/IUPAC Name]
(1-{[1-(2-Methylbenzyl)-1H-indol-2-yl]methyl}-4-piperidinyl)(4-methyl-1-piperidinyl)methanone [ACD/IUPAC Name]
(1-{[1-(2-Méthylbenzyl)-1H-indol-2-yl]méthyl}-4-pipéridinyl)(4-méthyl-1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[[1-[(2-methylphenyl)methyl]-1H-indol-2-yl]methyl]-4-piperidinyl](4-methyl-1-piperidinyl)- [ACD/Index Name]
1-(2-methylbenzyl)-2-({4-[(4-methylpiperidin-1-yl)carbonyl]piperidin-1-yl}methyl)-1H-indole

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

Density: 1.2±0.1 g/cm3
Boiling Point: 634.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.3±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 135.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.79
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 21.87
ACD/KOC (pH 5.5): 48.34
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 692.08
ACD/KOC (pH 7.4): 1529.53
Polar Surface Area: 28 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 384.4±7.0 cm3

Click to predict properties on the Chemicalize site


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