ChemSpider 2D Image | 1-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]methyl}urea | C15H18N8O2

1-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]methyl}urea

  • Molecular FormulaC15H18N8O2
  • Average mass342.356 Da
  • Monoisotopic mass342.155273 Da
  • ChemSpider ID30945150

More details:

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

1-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]methyl}harnstoff [German] [ACD/IUPAC Name]
1-(1-Ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-3-{[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]methyl}urea [ACD/IUPAC Name]
1-(1-Éthyl-3,5-diméthyl-1H-pyrazol-4-yl)-3-{[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]méthyl}urée [French] [ACD/IUPAC Name]
Urea, N-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N'-[[3-(2-pyrimidinyl)-1,2,4-oxadiazol-5-yl]methyl]- [ACD/Index Name]
N-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-N'-[(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)methyl]urea

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.708
Molar Refractivity: 91.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.94
ACD/LogD (pH 5.5): 1.12
ACD/BCF (pH 5.5): 4.15
ACD/KOC (pH 5.5): 96.20
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 7.4): 4.18
ACD/KOC (pH 7.4): 96.85
Polar Surface Area: 124 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 233.4±7.0 cm3

Click to predict properties on the Chemicalize site


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