ChemSpider 2D Image | (5S)-2-amino-5-(2',5'-difluorobiphenyl-3-yl)-3-methyl-5-pyridin-4-yl-3,5-dihydro-4H-imidazol-4-one | C21H16F2N4O

(5S)-2-amino-5-(2',5'-difluorobiphenyl-3-yl)-3-methyl-5-pyridin-4-yl-3,5-dihydro-4H-imidazol-4-one

  • Molecular FormulaC21H16F2N4O
  • Average mass378.375 Da
  • Monoisotopic mass378.129211 Da
  • ChemSpider ID24668875

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-2-Amino-5-(2',5'-difluor-3-biphenylyl)-3-methyl-5-(4-pyridinyl)-3,5-dihydro-4H-imidazol-4-on [German] [ACD/IUPAC Name]
(5S)-2-Amino-5-(2',5'-difluoro-3-biphenylyl)-3-methyl-5-(4-pyridinyl)-3,5-dihydro-4H-imidazol-4-one [ACD/IUPAC Name]
(5S)-2-Amino-5-(2',5'-difluoro-3-biphénylyl)-3-méthyl-5-(4-pyridinyl)-3,5-dihydro-4H-imidazol-4-one [French] [ACD/IUPAC Name]
(5S)-2-amino-5-(2',5'-difluorobiphenyl-3-yl)-3-methyl-5-pyridin-4-yl-3,5-dihydro-4H-imidazol-4-one
4H-Imidazol-4-one, 2-amino-5-(2',5'-difluoro[1,1'-biphenyl]-3-yl)-3,5-dihydro-3-methyl-5-(4-pyridinyl)-, (5S)- [ACD/Index Name]
(S)-2-amino-4-(2',5'-difluorobiphenyl-3-yl)-1-methyl-4-(pyridin-4-yl)-1H-imidazol-5(4H)-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 545.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.4±32.9 °C
Index of Refraction: 1.646
Molar Refractivity: 102.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 11.34
ACD/KOC (pH 5.5): 131.87
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 45.44
ACD/KOC (pH 7.4): 528.55
Polar Surface Area: 72 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 48.1±7.0 dyne/cm
Molar Volume: 281.0±7.0 cm3

Click to predict properties on the Chemicalize site


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