ChemSpider 2D Image | N-[3-(Dimethylamino)propyl]-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide | C31H38N6O2

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

  • Molecular FormulaC31H38N6O2
  • Average mass526.672 Da
  • Monoisotopic mass526.305603 Da
  • ChemSpider ID24808737

More details:

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

Benzamide, N-[3-(dimethylamino)propyl]-3-[3-(1,1-dimethylethyl)-5-[[(1-naphthalenylamino)carbonyl]amino]-1H-pyrazol-1-yl]-N-methyl- [ACD/Index Name]
N-[3-(Dimethylamino)propyl]-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamid [German] [ACD/IUPAC Name]
N-[3-(Dimethylamino)propyl]-N-methyl-3-{3-(2-methyl-2-propanyl)-5-[(1-naphthylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [ACD/IUPAC Name]
N-[3-(Diméthylamino)propyl]-N-méthyl-3-{3-(2-méthyl-2-propanyl)-5-[(1-naphtylcarbamoyl)amino]-1H-pyrazol-1-yl}benzamide [French] [ACD/IUPAC Name]
Kinome_2149

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

Density: 1.1±0.1 g/cm3
Boiling Point: 641.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 341.7±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 157.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 3.23
ACD/KOC (pH 5.5): 11.06
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 38.78
ACD/KOC (pH 7.4): 132.84
Polar Surface Area: 83 Å2
Polarizability: 62.4±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 458.0±7.0 cm3

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