ChemSpider 2D Image | (5S)-2-Amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(5-pyrimidinyl)phenyl]-3,5-dihydro-4H-imidazol-4-one | C19H19N7O

(5S)-2-Amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(5-pyrimidinyl)phenyl]-3,5-dihydro-4H-imidazol-4-one

  • Molecular FormulaC19H19N7O
  • Average mass361.401 Da
  • Monoisotopic mass361.165100 Da
  • ChemSpider ID26325853

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-2-Amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(5-pyrimidinyl)phenyl]-3,5-dihydro-4H-imidazol-4-on [German] [ACD/IUPAC Name]
(5S)-2-Amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(5-pyrimidinyl)phenyl]-3,5-dihydro-4H-imidazol-4-one [ACD/IUPAC Name]
(5S)-2-Amino-5-(1-éthyl-1H-pyrazol-4-yl)-3-méthyl-5-[3-(5-pyrimidinyl)phényl]-3,5-dihydro-4H-imidazol-4-one [French] [ACD/IUPAC Name]
(5s)-2-Amino-5-(1-Ethyl-1h-Pyrazol-4-Yl)-3-Methyl-5-[3-(Pyrimidin-5-Yl)phenyl]-3,5-Dihydro-4h-Imidazol-4-One
4H-Imidazol-4-one, 2-amino-5-(1-ethyl-1H-pyrazol-4-yl)-3,5-dihydro-3-methyl-5-[3-(5-pyrimidinyl)phenyl]-, (5S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 596.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.3±32.9 °C
Index of Refraction: 1.714
Molar Refractivity: 103.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.46
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.40
ACD/LogD (pH 7.4): 0.49
ACD/BCF (pH 7.4): 1.36
ACD/KOC (pH 7.4): 42.09
Polar Surface Area: 102 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 59.5±7.0 dyne/cm
Molar Volume: 262.4±7.0 cm3

Click to predict properties on the Chemicalize site


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