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Search term: UWMWZHPGGARJJI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Methyl-2-propanyl (5R)-7-[1-(methylamino)-1-oxo-3-phenyl-2-propanyl]-6,8,10-trioxo-1,7,9-triazaspiro[4.5]decane-1-carboxylate | C22H28N4O6

2-Methyl-2-propanyl (5R)-7-[1-(methylamino)-1-oxo-3-phenyl-2-propanyl]-6,8,10-trioxo-1,7,9-triazaspiro[4.5]decane-1-carboxylate

  • Molecular FormulaC22H28N4O6
  • Average mass444.481 Da
  • Monoisotopic mass444.200897 Da
  • ChemSpider ID30651125

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(5R)-7-[1-(Méthylamino)-1-oxo-3-phényl-2-propanyl]-6,8,10-trioxo-1,7,9-triazaspiro[4.5]décane-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1,7,9-Triazaspiro[4.5]decane-1-carboxylic acid, 7-[2-(methylamino)-2-oxo-1-(phenylmethyl)ethyl]-6,8,10-trioxo-, 1,1-dimethylethyl ester, (5R)- [ACD/Index Name]
2-Methyl-2-propanyl (5R)-7-[1-(methylamino)-1-oxo-3-phenyl-2-propanyl]-6,8,10-trioxo-1,7,9-triazaspiro[4.5]decane-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(5R)-7-[1-(methylamino)-1-oxo-3-phenyl-2-propanyl]-6,8,10-trioxo-1,7,9-triazaspiro[4.5]decan-1-carboxylat [German] [ACD/IUPAC 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: 646.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 344.6±34.3 °C
Index of Refraction: 1.618
Molar Refractivity: 116.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.03
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 52.6±7.0 dyne/cm
Molar Volume: 332.1±7.0 cm3

Click to predict properties on the Chemicalize site


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