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Search term: HAZXGSRKGXRAOD (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(1-Ethyl-1H-imidazol-2-yl)methyl]-7-(2-fluoro-5-methoxybenzyl)-2,7-diazaspiro[4.5]decan-6-one | C22H29FN4O2

2-[(1-Ethyl-1H-imidazol-2-yl)methyl]-7-(2-fluoro-5-methoxybenzyl)-2,7-diazaspiro[4.5]decan-6-one

  • Molecular FormulaC22H29FN4O2
  • Average mass400.490 Da
  • Monoisotopic mass400.227448 Da
  • ChemSpider ID22220561

More details:

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

2,7-Diazaspiro[4.5]decan-6-one, 2-[(1-ethyl-1H-imidazol-2-yl)methyl]-7-[(2-fluoro-5-methoxyphenyl)methyl]- [ACD/Index Name]
2-[(1-Ethyl-1H-imidazol-2-yl)methyl]-7-(2-fluor-5-methoxybenzyl)-2,7-diazaspiro[4.5]decan-6-on [German] [ACD/IUPAC Name]
2-[(1-Ethyl-1H-imidazol-2-yl)methyl]-7-(2-fluoro-5-methoxybenzyl)-2,7-diazaspiro[4.5]decan-6-one [ACD/IUPAC Name]
2-[(1-Éthyl-1H-imidazol-2-yl)méthyl]-7-(2-fluoro-5-méthoxybenzyl)-2,7-diazaspiro[4.5]décan-6-one [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: 613.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.5±31.5 °C
Index of Refraction: 1.610
Molar Refractivity: 110.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.58
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 10.18
ACD/KOC (pH 7.4): 106.16
Polar Surface Area: 51 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 319.9±7.0 cm3

Click to predict properties on the Chemicalize site


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