ChemSpider 2D Image | 2-Methyl-2-propanyl {2-[(3-{3-[(diethylcarbamoyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoyl)amino]ethyl}carbamate | C18H31N7O5

2-Methyl-2-propanyl {2-[(3-{3-[(diethylcarbamoyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoyl)amino]ethyl}carbamate

  • Molecular FormulaC18H31N7O5
  • Average mass425.483 Da
  • Monoisotopic mass425.238678 Da
  • ChemSpider ID66920821

More details:

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

{2-[(3-{3-[(Diéthylcarbamoyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoyl)amino]éthyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {2-[(3-{3-[(diethylcarbamoyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoyl)amino]ethyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{2-[(3-{3-[(diethylcarbamoyl)amino]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoyl)amino]ethyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[2-[[3-[3-[[(diethylamino)carbonyl]amino]-4,5-dihydro-5-oxo-1,2,4-triazin-6-yl]-1-oxopropyl]amino]ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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: 1.580
Molar Refractivity: 109.6±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: -1.39
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.11
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.35
Polar Surface Area: 154 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 329.4±7.0 cm3

Click to predict properties on the Chemicalize site


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