ChemSpider 2D Image | 6,7-Dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl[4-(methylsulfonyl)-1-piperazinyl]methanone | C12H18N4O4S

6,7-Dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl[4-(methylsulfonyl)-1-piperazinyl]methanone

  • Molecular FormulaC12H18N4O4S
  • Average mass314.361 Da
  • Monoisotopic mass314.104889 Da
  • ChemSpider ID28435801

More details:

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

6,7-Dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl[4-(methylsulfonyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
6,7-Dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl[4-(methylsulfonyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
6,7-Dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl[4-(méthylsulfonyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)[4-(methylsulfonyl)-1-piperazinyl]- [ACD/Index Name]
(6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl)(4-(methylsulfonyl)piperazin-1-yl)methanone
1448066-83-8 [RN]
1-methanesulfonyl-4-{5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine-2-carbonyl}piperazine
6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-2-yl-(4-methylsulfonylpiperazin-1-yl)methanone

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 569.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 85.4±3.0 kJ/mol
    Flash Point: 298.1±32.9 °C
    Index of Refraction: 1.693
    Molar Refractivity: 76.9±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -1.33
    ACD/LogD (pH 5.5): -0.77
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 9.02
    ACD/LogD (pH 7.4): -0.77
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 9.02
    Polar Surface Area: 93 Å2
    Polarizability: 30.5±0.5 10-24cm3
    Surface Tension: 67.0±7.0 dyne/cm
    Molar Volume: 200.6±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement