ChemSpider 2D Image | 3-{1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidinyl}-6-fluoro-2,4(1H,3H)-quinazolinedione | C18H19FN4O5S

3-{1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidinyl}-6-fluoro-2,4(1H,3H)-quinazolinedione

  • Molecular FormulaC18H19FN4O5S
  • Average mass422.431 Da
  • Monoisotopic mass422.106018 Da
  • ChemSpider ID34487000

More details:

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

2,4(1H,3H)-Quinazolinedione, 3-[1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-4-piperidinyl]-6-fluoro- [ACD/Index Name]
3-{1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidinyl}-6-fluor-2,4(1H,3H)-chinazolindion [German] [ACD/IUPAC Name]
3-{1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-4-piperidinyl}-6-fluoro-2,4(1H,3H)-quinazolinedione [ACD/IUPAC Name]
3-{1-[(3,5-Diméthyl-1,2-oxazol-4-yl)sulfonyl]-4-pipéridinyl}-6-fluoro-2,4(1H,3H)-quinazolinedione [French] [ACD/IUPAC Name]
3-(1-((3,5-dimethylisoxazol-4-yl)sulfonyl)piperidin-4-yl)-6-fluoroquinazoline-2,4(1H,3H)-dione

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.611
Molar Refractivity: 99.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 9.09
ACD/KOC (pH 5.5): 168.94
ACD/LogD (pH 7.4): 1.56
ACD/BCF (pH 7.4): 9.09
ACD/KOC (pH 7.4): 168.92
Polar Surface Area: 121 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 287.6±3.0 cm3

Click to predict properties on the Chemicalize site


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