ChemSpider 2D Image | N-(2,4-Dimethoxybenzyl)-4-{5-[(4-methyl-1-piperidinyl)methyl]-1H-tetrazol-1-yl}butanamide | C21H32N6O3

N-(2,4-Dimethoxybenzyl)-4-{5-[(4-methyl-1-piperidinyl)methyl]-1H-tetrazol-1-yl}butanamide

  • Molecular FormulaC21H32N6O3
  • Average mass416.517 Da
  • Monoisotopic mass416.253601 Da
  • ChemSpider ID22189688

More details:

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

1H-Tetrazole-1-butanamide, N-[(2,4-dimethoxyphenyl)methyl]-5-[(4-methyl-1-piperidinyl)methyl]- [ACD/Index Name]
N-(2,4-Dimethoxybenzyl)-4-{5-[(4-methyl-1-piperidinyl)methyl]-1H-tetrazol-1-yl}butanamid [German] [ACD/IUPAC Name]
N-(2,4-Dimethoxybenzyl)-4-{5-[(4-methyl-1-piperidinyl)methyl]-1H-tetrazol-1-yl}butanamide [ACD/IUPAC Name]
N-(2,4-Diméthoxybenzyl)-4-{5-[(4-méthyl-1-pipéridinyl)méthyl]-1H-tétrazol-1-yl}butanamide [French] [ACD/IUPAC 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: 670.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 359.5±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 114.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.49
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 8.85
ACD/KOC (pH 7.4): 158.93
Polar Surface Area: 94 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 46.5±7.0 dyne/cm
Molar Volume: 333.0±7.0 cm3

Click to predict properties on the Chemicalize site


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