ChemSpider 2D Image | 2-[8-(4-Hexylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-(4-methoxyphenyl)acetamide | C35H42N4O4

2-[8-(4-Hexylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-(4-methoxyphenyl)acetamide

  • Molecular FormulaC35H42N4O4
  • Average mass582.732 Da
  • Monoisotopic mass582.320618 Da
  • ChemSpider ID3370247

More details:

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

1,3,8-Triazaspiro[4.5]decane-3-acetamide, 8-(4-hexylbenzoyl)-N-(4-methoxyphenyl)-4-oxo-1-phenyl- [ACD/Index Name]
2-[8-(4-Hexylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-(4-methoxyphenyl)acetamid [German] [ACD/IUPAC Name]
2-[8-(4-Hexylbenzoyl)-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]-N-(4-methoxyphenyl)acetamide [ACD/IUPAC Name]
2-[8-(4-Hexylbenzoyl)-4-oxo-1-phényl-1,3,8-triazaspiro[4.5]déc-3-yl]-N-(4-méthoxyphényl)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: 824.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 452.2±34.3 °C
Index of Refraction: 1.635
Molar Refractivity: 168.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.60
ACD/LogD (pH 5.5): 5.42
ACD/BCF (pH 5.5): 7691.35
ACD/KOC (pH 5.5): 21046.72
ACD/LogD (pH 7.4): 5.42
ACD/BCF (pH 7.4): 7691.72
ACD/KOC (pH 7.4): 21047.74
Polar Surface Area: 82 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 469.7±5.0 cm3

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