ChemSpider 2D Image | 4-[({5-[(4-Chlorophenoxy)methyl]-2-furyl}methylene)amino]-N-(2-furylmethyl)-1-methyl-1H-pyrazole-5-carboxamide | C22H19ClN4O4

4-[({5-[(4-Chlorophenoxy)methyl]-2-furyl}methylene)amino]-N-(2-furylmethyl)-1-methyl-1H-pyrazole-5-carboxamide

  • Molecular FormulaC22H19ClN4O4
  • Average mass438.864 Da
  • Monoisotopic mass438.109497 Da
  • ChemSpider ID35406733

More details:

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

1H-Pyrazole-5-carboxamide, 4-[[[5-[(4-chlorophenoxy)methyl]-2-furanyl]methylene]amino]-N-(2-furanylmethyl)-1-methyl- [ACD/Index Name]
4-[({5-[(4-Chlorophenoxy)methyl]-2-furyl}methylene)amino]-N-(2-furylmethyl)-1-methyl-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
4-[({5-[(4-Chlorophénoxy)méthyl]-2-furyl}méthylène)amino]-N-(2-furylméthyl)-1-méthyl-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
4-[({5-[(4-Chlorphenoxy)methyl]-2-furyl}methylen)amino]-N-(2-furylmethyl)-1-methyl-1H-pyrazol-5-carboxamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 688.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 370.1±31.5 °C
Index of Refraction: 1.641
Molar Refractivity: 116.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 182.48
ACD/KOC (pH 5.5): 1445.95
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 182.53
ACD/KOC (pH 7.4): 1446.33
Polar Surface Area: 95 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 322.5±7.0 cm3

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