ChemSpider 2D Image | (4S)-6-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-(2-hydroxyethoxy)-3-methyl-3,4-dihydro-2(1H)-quinazolinone | C16H19N3O4

(4S)-6-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-(2-hydroxyethoxy)-3-methyl-3,4-dihydro-2(1H)-quinazolinone

  • Molecular FormulaC16H19N3O4
  • Average mass317.340 Da
  • Monoisotopic mass317.137543 Da
  • ChemSpider ID26329321

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-6-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-(2-hydroxyethoxy)-3-methyl-3,4-dihydro-2(1H)-chinazolinon [German] [ACD/IUPAC Name]
(4S)-6-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-(2-hydroxyethoxy)-3-methyl-3,4-dihydro-2(1H)-quinazolinone [ACD/IUPAC Name]
(4S)-6-(3,5-Diméthyl-1,2-oxazol-4-yl)-4-(2-hydroxyéthoxy)-3-méthyl-3,4-dihydro-2(1H)-quinazolinone [French] [ACD/IUPAC Name]
(4s)-6-(3,5-Dimethyl-1,2-Oxazol-4-Yl)-4-(2-Hydroxyethoxy)-3-Methyl-3,4-Dihydroquinazolin-2(1h)-One
2(1H)-Quinazolinone, 6-(3,5-dimethyl-4-isoxazolyl)-3,4-dihydro-4-(2-hydroxyethoxy)-3-methyl-, (4S)- [ACD/Index Name]
WDR

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

Density: 1.4±0.1 g/cm3
Boiling Point: 542.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 281.7±30.1 °C
Index of Refraction: 1.625
Molar Refractivity: 83.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.63
ACD/KOC (pH 5.5): 87.54
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.63
ACD/KOC (pH 7.4): 87.54
Polar Surface Area: 88 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 65.3±5.0 dyne/cm
Molar Volume: 234.7±5.0 cm3

Click to predict properties on the Chemicalize site


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