ChemSpider 2D Image | N-Acetyl-N-{1-[(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]-4-azepanyl}glycine | C16H23N5O6

N-Acetyl-N-{1-[(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]-4-azepanyl}glycine

  • Molecular FormulaC16H23N5O6
  • Average mass381.384 Da
  • Monoisotopic mass381.164825 Da
  • ChemSpider ID54517000

More details:

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

Glycine, N-acetyl-N-[hexahydro-1-[2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]-1H-azepin-4-yl]- [ACD/Index Name]
N-Acetyl-N-{1-[(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]-4-azepanyl}glycin [German] [ACD/IUPAC Name]
N-Acetyl-N-{1-[(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]-4-azepanyl}glycine [ACD/IUPAC Name]
N-Acétyl-N-{1-[2-(2-méthyl-4-nitro-1H-imidazol-1-yl)acétyl]-4-azépanyl}glycine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 703.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 108.1±3.0 kJ/mol
Flash Point: 379.4±32.9 °C
Index of Refraction: 1.641
Molar Refractivity: 94.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.49
ACD/LogD (pH 5.5): -2.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 142 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 62.0±7.0 dyne/cm
Molar Volume: 262.9±7.0 cm3

Click to predict properties on the Chemicalize site


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