ChemSpider 2D Image | 1-(1-Isopropyl-1H-1,2,3-triazol-4-yl)-3-{1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl}urea | C15H18N8O2

1-(1-Isopropyl-1H-1,2,3-triazol-4-yl)-3-{1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl}urea

  • Molecular FormulaC15H18N8O2
  • Average mass342.356 Da
  • Monoisotopic mass342.155273 Da
  • ChemSpider ID30948252

More details:

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

1-(1-Isopropyl-1H-1,2,3-triazol-4-yl)-3-{1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl}harnstoff [German] [ACD/IUPAC Name]
1-(1-Isopropyl-1H-1,2,3-triazol-4-yl)-3-{1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl}urea [ACD/IUPAC Name]
1-(1-Isopropyl-1H-1,2,3-triazol-4-yl)-3-{1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]éthyl}urée [French] [ACD/IUPAC Name]
Urea, N-[1-(1-methylethyl)-1H-1,2,3-triazol-4-yl]-N'-[1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl]- [ACD/Index Name]
N-(1-isopropyl-1H-1,2,3-triazol-4-yl)-N'-[1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl]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: 0.86
ACD/LogD (pH 5.5): 0.82
ACD/BCF (pH 5.5): 2.47
ACD/KOC (pH 5.5): 66.45
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 2.47
ACD/KOC (pH 7.4): 66.45
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


Advertisement