ChemSpider 2D Image | 2-Methyl-2-propanyl (2-{[3-(3-{[(1-methyl-4-piperidinyl)carbonyl]amino}-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propanoyl]amino}ethyl)carbamate | C20H33N7O5

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

  • Molecular FormulaC20H33N7O5
  • Average mass451.520 Da
  • Monoisotopic mass451.254303 Da
  • ChemSpider ID66792182

More details:






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

(2-{[3-(3-{[(1-Méthyl-4-pipéridinyl)carbonyl]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-{[(1-methyl-4-piperidinyl)carbonyl]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-{[(1-methyl-4-piperidinyl)carbonyl]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-[4,5-dihydro-3-[[(1-methyl-4-piperidinyl)carbonyl]amino]-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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 116.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -1.64
ACD/LogD (pH 5.5): -3.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 154 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 333.8±7.0 cm3

Click to predict properties on the Chemicalize site






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