ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-[4-oxo-8-(4-pentylbenzoyl)-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]acetamide | C37H46N4O5

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-[4-oxo-8-(4-pentylbenzoyl)-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]acetamide

  • Molecular FormulaC37H46N4O5
  • Average mass626.785 Da
  • Monoisotopic mass626.346802 Da
  • ChemSpider ID4420986

More details:

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

1,3,8-Triazaspiro[4.5]decane-3-acetamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-8-(4-pentylbenzoyl)-1-phenyl- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-[4-oxo-8-(4-pentylbenzoyl)-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]acetamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-[4-oxo-8-(4-pentylbenzoyl)-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]acetamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-2-[4-oxo-8-(4-pentylbenzoyl)-1-phényl-1,3,8-triazaspiro[4.5]déc-3-yl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 853.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.1±3.0 kJ/mol
Flash Point: 470.1±34.3 °C
Index of Refraction: 1.625
Molar Refractivity: 179.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 4.99
ACD/BCF (pH 5.5): 3619.31
ACD/KOC (pH 5.5): 12270.38
ACD/LogD (pH 7.4): 4.99
ACD/BCF (pH 7.4): 3619.34
ACD/KOC (pH 7.4): 12270.46
Polar Surface Area: 91 Å2
Polarizability: 71.0±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 507.2±5.0 cm3

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