ChemSpider 2D Image | 7-(2-Fluoro-5-methoxybenzyl)-2-[(1-methyl-1H-imidazol-2-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one | C21H27FN4O2

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

  • Molecular FormulaC21H27FN4O2
  • Average mass386.463 Da
  • Monoisotopic mass386.211792 Da
  • ChemSpider ID22244863

More details:

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

2,7-Diazaspiro[4.5]decan-6-one, 7-[(2-fluoro-5-methoxyphenyl)methyl]-2-[(1-methyl-1H-imidazol-2-yl)methyl]- [ACD/Index Name]
7-(2-Fluor-5-methoxybenzyl)-2-[(1-methyl-1H-imidazol-2-yl)methyl]-2,7-diazaspiro[4.5]decan-6-on [German] [ACD/IUPAC Name]
7-(2-Fluoro-5-methoxybenzyl)-2-[(1-methyl-1H-imidazol-2-yl)methyl]-2,7-diazaspiro[4.5]decan-6-one [ACD/IUPAC Name]
7-(2-Fluoro-5-méthoxybenzyl)-2-[(1-méthyl-1H-imidazol-2-yl)méthyl]-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: 607.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 321.0±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 106.3±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 5.07
ACD/KOC (pH 7.4): 65.71
Polar Surface Area: 51 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 303.8±7.0 cm3

Click to predict properties on the Chemicalize site


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