ChemSpider 2D Image | N-(2-Methoxyethyl)-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide | C29H33N5O3

N-(2-Methoxyethyl)-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide

  • Molecular FormulaC29H33N5O3
  • Average mass499.604 Da
  • Monoisotopic mass499.258331 Da
  • ChemSpider ID24808741

More details:

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

Benzamide, 3-[3-(1,1-dimethylethyl)-5-[[(1-naphthalenylamino)carbonyl]amino]-1H-pyrazol-1-yl]-N-(2-methoxyethyl)-N-methyl- [ACD/Index Name]
N-(2-Methoxyethyl)-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamid [German] [ACD/IUPAC Name]
N-(2-Methoxyethyl)-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [ACD/IUPAC Name]
N-(2-Méthoxyéthyl)-N-méthyl-3-{3-(2-méthyl-2-propanyl)-5-[(1-naphtylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [French] [ACD/IUPAC Name]
Kinome_2141

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

Density: 1.2±0.1 g/cm3
Boiling Point: 624.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.4±3.0 kJ/mol
Flash Point: 331.2±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 145.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 5.07
ACD/BCF (pH 5.5): 4212.38
ACD/KOC (pH 5.5): 13677.76
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 4212.84
ACD/KOC (pH 7.4): 13679.25
Polar Surface Area: 88 Å2
Polarizability: 57.8±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 422.5±7.0 cm3

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