ChemSpider 2D Image | N-[3-(4-{4-[(1-Methyl-1H-imidazol-2-yl)methyl]-1-piperazinyl}-1-piperidinyl)phenyl]nicotinamide | C26H33N7O

N-[3-(4-{4-[(1-Methyl-1H-imidazol-2-yl)methyl]-1-piperazinyl}-1-piperidinyl)phenyl]nicotinamide

  • Molecular FormulaC26H33N7O
  • Average mass459.586 Da
  • Monoisotopic mass459.274658 Da
  • ChemSpider ID22156352

More details:

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

3-Pyridinecarboxamide, N-[3-[4-[4-[(1-methyl-1H-imidazol-2-yl)methyl]-1-piperazinyl]-1-piperidinyl]phenyl]- [ACD/Index Name]
N-[3-(4-{4-[(1-Methyl-1H-imidazol-2-yl)methyl]-1-piperazinyl}-1-piperidinyl)phenyl]nicotinamid [German] [ACD/IUPAC Name]
N-[3-(4-{4-[(1-Methyl-1H-imidazol-2-yl)methyl]-1-piperazinyl}-1-piperidinyl)phenyl]nicotinamide [ACD/IUPAC Name]
N-[3-(4-{4-[(1-Méthyl-1H-imidazol-2-yl)méthyl]-1-pipérazinyl}-1-pipéridinyl)phényl]nicotinamide [French] [ACD/IUPAC Name]
N-[3-(4-{4-[(1-METHYL-1H-IMIDAZOL-2-YL)METHYL]PIPERAZIN-1-YL}PIPERIDIN-1-YL)PHENYL]PYRIDINE-3-CARBOXAMIDE
N-[3-(4-{4-[(1-METHYLIMIDAZOL-2-YL)METHYL]PIPERAZIN-1-YL}PIPERIDIN-1-YL)PHENYL]PYRIDINE-3-CARBOXAMIDE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 620.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.0±3.0 kJ/mol
Flash Point: 329.3±31.5 °C
Index of Refraction: 1.671
Molar Refractivity: 135.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.07
ACD/LogD (pH 5.5): -2.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 26.75
Polar Surface Area: 70 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 361.8±7.0 cm3

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