ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-1-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide | C25H19Cl2N3O4

N-(1,3-Benzodioxol-5-ylmethyl)-1-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide

  • Molecular FormulaC25H19Cl2N3O4
  • Average mass496.342 Da
  • Monoisotopic mass495.075256 Da
  • ChemSpider ID22568821

More details:

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

1H-Pyrazole-5-carboxamide, N-(1,3-benzodioxol-5-ylmethyl)-1-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-1-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-1-(3,4-dichlorophényl)-3-(3-méthoxyphényl)-1H-pyrazole-5-carboxamide [French] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-1-(3,4-dichlorphenyl)-3-(3-methoxyphenyl)-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: 696.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.1±3.0 kJ/mol
Flash Point: 375.3±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 129.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.49
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2158.16
ACD/KOC (pH 5.5): 8474.88
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2157.77
ACD/KOC (pH 7.4): 8473.33
Polar Surface Area: 75 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 52.3±7.0 dyne/cm
Molar Volume: 346.8±7.0 cm3

Click to predict properties on the Chemicalize site


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