ChemSpider 2D Image | 1-Ethyl-1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-3-(1-methyl-1H-1,2,3-triazol-4-yl)urea | C13H21N7O2

1-Ethyl-1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-3-(1-methyl-1H-1,2,3-triazol-4-yl)urea

  • Molecular FormulaC13H21N7O2
  • Average mass307.352 Da
  • Monoisotopic mass307.175659 Da
  • ChemSpider ID52570795

More details:

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

1-Ethyl-1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-3-(1-methyl-1H-1,2,3-triazol-4-yl)harnstoff [German] [ACD/IUPAC Name]
1-Ethyl-1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-3-(1-methyl-1H-1,2,3-triazol-4-yl)urea [ACD/IUPAC Name]
1-Éthyl-1-[(5-isobutyl-1,2,4-oxadiazol-3-yl)méthyl]-3-(1-méthyl-1H-1,2,3-triazol-4-yl)urée [French] [ACD/IUPAC Name]
Urea, N-ethyl-N-[[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]-N'-(1-methyl-1H-1,2,3-triazol-4-yl)- [ACD/Index Name]
N-ethyl-N-[(5-isobutyl-1,2,4-oxadiazol-3-yl)methyl]-N'-(1-methyl-1H-1,2,3-triazol-4-yl)urea

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.631
Molar Refractivity: 82.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.01
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.28
ACD/KOC (pH 5.5): 98.56
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.28
ACD/KOC (pH 7.4): 98.52
Polar Surface Area: 102 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 230.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement