ChemSpider 2D Image | 2-[{2-[(2,6-Dichlorophenyl)amino]-2-oxoethyl}(methyl)amino]-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)acetamide | C21H21Cl2N5O2

2-[{2-[(2,6-Dichlorophenyl)amino]-2-oxoethyl}(methyl)amino]-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)acetamide

  • Molecular FormulaC21H21Cl2N5O2
  • Average mass446.330 Da
  • Monoisotopic mass445.107239 Da
  • ChemSpider ID21718138

More details:

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

2-[{2-[(2,6-Dichlorophenyl)amino]-2-oxoethyl}(methyl)amino]-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)acetamide [ACD/IUPAC Name]
2-[{2-[(2,6-Dichlorophényl)amino]-2-oxoéthyl}(méthyl)amino]-N-(3-méthyl-1-phényl-1H-pyrazol-5-yl)acétamide [French] [ACD/IUPAC Name]
2-[{2-[(2,6-Dichlorphenyl)amino]-2-oxoethyl}(methyl)amino]-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)acetamid [German] [ACD/IUPAC Name]
Acetamide, 2-[[2-[(2,6-dichlorophenyl)amino]-2-oxoethyl]methylamino]-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)- [ACD/Index 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: 668.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.2±3.0 kJ/mol
Flash Point: 357.9±31.5 °C
Index of Refraction: 1.638
Molar Refractivity: 119.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 103.14
ACD/KOC (pH 5.5): 949.56
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 107.59
ACD/KOC (pH 7.4): 990.55
Polar Surface Area: 79 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 332.1±7.0 cm3

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