ChemSpider 2D Image | (5S)-2-amino-3-methyl-5-pyridin-4-yl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one | C20H17N5O

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

  • Molecular FormulaC20H17N5O
  • Average mass343.382 Da
  • Monoisotopic mass343.143311 Da
  • ChemSpider ID25057804

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-2-Amino-3-methyl-5-(4-pyridinyl)-5-[3-(3-pyridinyl)phenyl]-3,5-dihydro-4H-imidazol-4-on [German] [ACD/IUPAC Name]
(5S)-2-Amino-3-methyl-5-(4-pyridinyl)-5-[3-(3-pyridinyl)phenyl]-3,5-dihydro-4H-imidazol-4-one [ACD/IUPAC Name]
(5S)-2-Amino-3-méthyl-5-(4-pyridinyl)-5-[3-(3-pyridinyl)phényl]-3,5-dihydro-4H-imidazol-4-one [French] [ACD/IUPAC Name]
(5S)-2-amino-3-methyl-5-pyridin-4-yl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one
4H-Imidazol-4-one, 2-amino-3,5-dihydro-3-methyl-5-(4-pyridinyl)-5-[3-(3-pyridinyl)phenyl]-, (5S)- [ACD/Index 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: 570.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 298.7±32.9 °C
Index of Refraction: 1.689
Molar Refractivity: 100.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.60
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.04
ACD/KOC (pH 5.5): 22.76
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.84
ACD/KOC (pH 7.4): 106.22
Polar Surface Area: 84 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 55.7±7.0 dyne/cm
Molar Volume: 263.9±7.0 cm3

Click to predict properties on the Chemicalize site


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