ChemSpider 2D Image | 5-Pentyl-N-{[4'-(1-piperidinylcarbonyl)-4-biphenylyl]methyl}-N-[1-(2-pyridinylmethyl)-4-piperidinyl]-2-pyridinecarboxamide | C41H49N5O2

5-Pentyl-N-{[4'-(1-piperidinylcarbonyl)-4-biphenylyl]methyl}-N-[1-(2-pyridinylmethyl)-4-piperidinyl]-2-pyridinecarboxamide

  • Molecular FormulaC41H49N5O2
  • Average mass643.860 Da
  • Monoisotopic mass643.388611 Da
  • ChemSpider ID10137711

More details:

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

2-Pyridinecarboxamide, 5-pentyl-N-[[4'-(1-piperidinylcarbonyl)[1,1'-biphenyl]-4-yl]methyl]-N-[1-(2-pyridinylmethyl)-4-piperidinyl]- [ACD/Index Name]
5-Pentyl-N-{[4'-(1-piperidinylcarbonyl)-4-biphenylyl]methyl}-N-[1-(2-pyridinylmethyl)-4-piperidinyl]-2-pyridincarboxamid [German] [ACD/IUPAC Name]
5-Pentyl-N-{[4'-(1-piperidinylcarbonyl)-4-biphenylyl]methyl}-N-[1-(2-pyridinylmethyl)-4-piperidinyl]-2-pyridinecarboxamide [ACD/IUPAC Name]
5-Pentyl-N-{[4'-(1-pipéridinylcarbonyl)-4-biphénylyl]méthyl}-N-[1-(2-pyridinylméthyl)-4-pipéridinyl]-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
5-Pentyl-N-{[4'-(Piperidin-1-Ylcarbonyl)biphenyl-4-Yl]methyl}-N-[1-(Pyridin-2-Ylmethyl)piperidin-4-Yl]pyridine-2-Carboxamide
A1T

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

Density: 1.2±0.1 g/cm3
Boiling Point: 817.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.9±3.0 kJ/mol
Flash Point: 448.4±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 192.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 906.84
ACD/KOC (pH 5.5): 1858.38
ACD/LogD (pH 7.4): 5.89
ACD/BCF (pH 7.4): 16601.53
ACD/KOC (pH 7.4): 34021.21
Polar Surface Area: 70 Å2
Polarizability: 76.2±0.5 10-24cm3
Surface Tension: 61.8±5.0 dyne/cm
Molar Volume: 535.2±5.0 cm3

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