ChemSpider 2D Image | 1-(4-Benzyl-1-piperazinyl)-3-[1-(1H-indol-3-ylmethyl)-3-piperidinyl]-1-propanone | C28H36N4O

1-(4-Benzyl-1-piperazinyl)-3-[1-(1H-indol-3-ylmethyl)-3-piperidinyl]-1-propanone

  • Molecular FormulaC28H36N4O
  • Average mass444.612 Da
  • Monoisotopic mass444.288910 Da
  • ChemSpider ID22130456

More details:

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

1-(4-Benzyl-1-piperazinyl)-3-[1-(1H-indol-3-ylmethyl)-3-piperidinyl]-1-propanon [German] [ACD/IUPAC Name]
1-(4-Benzyl-1-piperazinyl)-3-[1-(1H-indol-3-ylmethyl)-3-piperidinyl]-1-propanone [ACD/IUPAC Name]
1-(4-Benzyl-1-pipérazinyl)-3-[1-(1H-indol-3-ylméthyl)-3-pipéridinyl]-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 3-[1-(1H-indol-3-ylmethyl)-3-piperidinyl]-1-[4-(phenylmethyl)-1-piperazinyl]- [ACD/Index Name]
1-(4-BENZYLPIPERAZIN-1-YL)-3-[1-(1H-INDOL-3-YLMETHYL)PIPERIDIN-3-YL]PROPAN-1-ONE
1-(4-BENZYLPIPERAZIN-1-YL)-3-{1-[(1H-INDOL-3-YL)METHYL]PIPERIDIN-3-YL}PROPAN-1-ONE
3-({3-[3-(4-benzyl-1-piperazinyl)-3-oxopropyl]-1-piperidinyl}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: 632.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.4±31.5 °C
Index of Refraction: 1.629
Molar Refractivity: 134.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.04
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 3.84
ACD/KOC (pH 7.4): 21.86
Polar Surface Area: 43 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 378.9±3.0 cm3

Click to predict properties on the Chemicalize site


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