ChemSpider 2D Image | 1H-Benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoro-1-pyrrolidinyl]methanone | C16H15F2N5O2

1H-Benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoro-1-pyrrolidinyl]methanone

  • Molecular FormulaC16H15F2N5O2
  • Average mass347.319 Da
  • Monoisotopic mass347.119385 Da
  • ChemSpider ID53588084

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluor-1-pyrrolidinyl]methanon [German] [ACD/IUPAC Name]
1H-Benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoro-1-pyrrolidinyl]methanone [ACD/IUPAC Name]
1H-Benzimidazol-5-yl[(2S)-2-(3-éthyl-1,2,4-oxadiazol-5-yl)-4,4-difluoro-1-pyrrolidinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, 1H-benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluoro-1-pyrrolidinyl]- [ACD/Index Name]
1H-1,3-benzimidazol-5-yl[(2S)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)-4,4-difluorotetrahydro-1H-pyrrol-1-yl]methanone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 636.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.7±34.3 °C
Index of Refraction: 1.631
Molar Refractivity: 83.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.21
ACD/LogD (pH 5.5): 0.70
ACD/BCF (pH 5.5): 1.90
ACD/KOC (pH 5.5): 51.98
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 2.33
ACD/KOC (pH 7.4): 63.68
Polar Surface Area: 88 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 70.7±5.0 dyne/cm
Molar Volume: 234.1±5.0 cm3

Click to predict properties on the Chemicalize site


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