ChemSpider 2D Image | 1-Isobutyl-8-(1-methoxy-2-propanyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione | C23H36N4O3

1-Isobutyl-8-(1-methoxy-2-propanyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione

  • Molecular FormulaC23H36N4O3
  • Average mass416.557 Da
  • Monoisotopic mass416.278748 Da
  • ChemSpider ID22149415

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 8-(2-methoxy-1-methylethyl)-1-(2-methylpropyl)-3-[3-(3-pyridinyl)propyl]- [ACD/Index Name]
1-Isobutyl-8-(1-methoxy-2-propanyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
1-Isobutyl-8-(1-methoxy-2-propanyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
1-Isobutyl-8-(1-méthoxy-2-propanyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]décane-2,4-dione [French] [ACD/IUPAC Name]
1-isobutyl-8-(2-methoxy-1-methylethyl)-3-[3-(3-pyridinyl)propyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione

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

Density: 1.2±0.1 g/cm3
Boiling Point: 529.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.5±3.0 kJ/mol
Flash Point: 274.3±32.9 °C
Index of Refraction: 1.566
Molar Refractivity: 117.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.15
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 3.41
ACD/KOC (pH 7.4): 40.02
Polar Surface Area: 66 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 51.3±5.0 dyne/cm
Molar Volume: 360.0±5.0 cm3

Click to predict properties on the Chemicalize site


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