ChemSpider 2D Image | 1-(2,6-Difluorophenyl)-3-[2-(1-methyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)ethyl]urea | C18H22F2N4O

1-(2,6-Difluorophenyl)-3-[2-(1-methyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)ethyl]urea

  • Molecular FormulaC18H22F2N4O
  • Average mass348.390 Da
  • Monoisotopic mass348.176178 Da
  • ChemSpider ID26298088

More details:

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

1-(2,6-Difluorophenyl)-3-[2-(1-methyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)ethyl]urea [ACD/IUPAC Name]
1-(2,6-Difluorophényl)-3-[2-(1-méthyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)éthyl]urée [French] [ACD/IUPAC Name]
1-(2,6-Difluorphenyl)-3-[2-(1-methyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)ethyl]harnstoff [German] [ACD/IUPAC Name]
1-(2,6-difluorophenyl)-3-(2-(1-methyl-1H-pyrrol-2-yl)-2-(pyrrolidin-1-yl)ethyl)urea
1-(2,6-difluorophenyl)-3-[2-(1-methyl-1H-pyrrol-2-yl)-2-(pyrrolidin-1-yl)ethyl]urea
1207002-87-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 447.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 224.5±28.7 °C
Index of Refraction: 1.599
Molar Refractivity: 92.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): -0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.11
ACD/KOC (pH 7.4): 14.10
Polar Surface Area: 49 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 270.0±7.0 cm3

Click to predict properties on the Chemicalize site


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