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Search term: YUAYIXDOZFBVPT-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-Methyl-2-propanyl 4-({8-[4-(2-methyl-2-propanyl)benzoyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl}acetyl)-1-piperazinecarboxylate | C35H47N5O5

2-Methyl-2-propanyl 4-({8-[4-(2-methyl-2-propanyl)benzoyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl}acetyl)-1-piperazinecarboxylate

  • Molecular FormulaC35H47N5O5
  • Average mass617.778 Da
  • Monoisotopic mass617.357727 Da
  • ChemSpider ID26379886

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[8-[4-(1,1-dimethylethyl)benzoyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl]acetyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-({8-[4-(2-methyl-2-propanyl)benzoyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl}acetyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-({8-[4-(2-methyl-2-propanyl)benzoyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]dec-3-yl}acetyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(2-{8-[4-(2-Méthyl-2-propanyl)benzoyl]-4-oxo-1-phényl-1,3,8-triazaspiro[4.5]déc-3-yl}acétyl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [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: 799.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.3±3.0 kJ/mol
Flash Point: 437.4±32.9 °C
Index of Refraction: 1.623
Molar Refractivity: 173.5±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1392.75
ACD/KOC (pH 5.5): 6194.15
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1392.76
ACD/KOC (pH 7.4): 6194.21
Polar Surface Area: 94 Å2
Polarizability: 68.8±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 492.1±5.0 cm3

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