ChemSpider 2D Image | 3-[1-(1-Azepanyl)-2-methyl-2-propanyl]-1-methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]urea | C16H29N5O2

3-[1-(1-Azepanyl)-2-methyl-2-propanyl]-1-methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]urea

  • Molecular FormulaC16H29N5O2
  • Average mass323.434 Da
  • Monoisotopic mass323.232117 Da
  • ChemSpider ID58191927

More details:

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

3-[1-(1-Azepanyl)-2-methyl-2-propanyl]-1-methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]harnstoff [German] [ACD/IUPAC Name]
3-[1-(1-Azepanyl)-2-methyl-2-propanyl]-1-methyl-1-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]urea [ACD/IUPAC Name]
3-[1-(1-Azépanyl)-2-méthyl-2-propanyl]-1-méthyl-1-[(5-méthyl-1,2,4-oxadiazol-3-yl)méthyl]urée [French] [ACD/IUPAC Name]
Urea, N'-[2-(hexahydro-1H-azepin-1-yl)-1,1-dimethylethyl]-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]- [ACD/Index Name]
N'-(2-azepan-1-yl-1,1-dimethylethyl)-N-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]urea

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.515
Molar Refractivity: 88.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): -0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.36
Polar Surface Area: 75 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 294.8±3.0 cm3

Click to predict properties on the Chemicalize site


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