ChemSpider 2D Image | (5S)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one | C23H22N4O2

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

  • Molecular FormulaC23H22N4O2
  • Average mass386.446 Da
  • Monoisotopic mass386.174286 Da
  • ChemSpider ID25058944

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)-3,5-dihydro-4H-imidazol-4-one
(5S)-2-Amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-[3-(3-pyridinyl)phenyl]-3,5-dihydro-4H-imidazol-4-on [German] [ACD/IUPAC Name]
(5S)-2-Amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-[3-(3-pyridinyl)phenyl]-3,5-dihydro-4H-imidazol-4-one [ACD/IUPAC Name]
(5S)-2-Amino-5-(4-méthoxy-3-méthylphényl)-3-méthyl-5-[3-(3-pyridinyl)phényl]-3,5-dihydro-4H-imidazol-4-one [French] [ACD/IUPAC Name]
4H-Imidazol-4-one, 2-amino-3,5-dihydro-5-(4-methoxy-3-methylphenyl)-3-methyl-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: 1.2±0.1 g/cm3
Boiling Point: 577.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 302.8±32.9 °C
Index of Refraction: 1.641
Molar Refractivity: 112.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 7.81
ACD/KOC (pH 5.5): 70.19
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 98.85
ACD/KOC (pH 7.4): 888.32
Polar Surface Area: 81 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 47.9±7.0 dyne/cm
Molar Volume: 312.1±7.0 cm3

Click to predict properties on the Chemicalize site


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