ChemSpider 2D Image | 1-(5-Fluoro-2-pyridinyl)-7'-[(3-methyl-1,2-oxazol-5-yl)acetyl]tetrahydro-5'H-spiro[azetidine-3,1'-[1,3]oxazolo[3,4-a]pyrazin]-3'-one | C19H20FN5O4

1-(5-Fluoro-2-pyridinyl)-7'-[(3-methyl-1,2-oxazol-5-yl)acetyl]tetrahydro-5'H-spiro[azetidine-3,1'-[1,3]oxazolo[3,4-a]pyrazin]-3'-one

  • Molecular FormulaC19H20FN5O4
  • Average mass401.392 Da
  • Monoisotopic mass401.149933 Da
  • ChemSpider ID71290774

More details:

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

1-(5-Fluoro-2-pyridinyl)-7'-[(3-methyl-1,2-oxazol-5-yl)acetyl]tetrahydro-5'H-spiro[azetidine-3,1'-[1,3]oxazolo[3,4-a]pyrazin]-3'-one [ACD/IUPAC Name]
Spiro[azetidine-3,1'(5'H)-[3H]oxazolo[3,4-a]pyrazin]-3'-one, 1-(5-fluoro-2-pyridinyl)tetrahydro-7'-[2-(3-methyl-5-isoxazolyl)acetyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 735.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 398.7±32.9 °C
Index of Refraction: 1.660
Molar Refractivity: 98.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 3.40
ACD/KOC (pH 5.5): 70.18
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.20
ACD/KOC (pH 7.4): 128.08
Polar Surface Area: 92 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 76.5±5.0 dyne/cm
Molar Volume: 265.6±5.0 cm3

Click to predict properties on the Chemicalize site


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