ChemSpider 2D Image | (5-Cyclopropyl-1,2-oxazol-3-yl){3-[4-(4-fluorophenyl)-1-piperazinyl]-1-piperidinyl}methanone | C22H27FN4O2

(5-Cyclopropyl-1,2-oxazol-3-yl){3-[4-(4-fluorophenyl)-1-piperazinyl]-1-piperidinyl}methanone

  • Molecular FormulaC22H27FN4O2
  • Average mass398.474 Da
  • Monoisotopic mass398.211792 Da
  • ChemSpider ID22160957

More details:

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

(5-Cyclopropyl-1,2-oxazol-3-yl){3-[4-(4-fluorophenyl)-1-piperazinyl]-1-piperidinyl}methanone [ACD/IUPAC Name]
(5-Cyclopropyl-1,2-oxazol-3-yl){3-[4-(4-fluorophényl)-1-pipérazinyl]-1-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
(5-Cyclopropyl-1,2-oxazol-3-yl){3-[4-(4-fluorphenyl)-1-piperazinyl]-1-piperidinyl}methanon [German] [ACD/IUPAC Name]
Methanone, (5-cyclopropyl-3-isoxazolyl)[3-[4-(4-fluorophenyl)-1-piperazinyl]-1-piperidinyl]- [ACD/Index Name]
(5-cyclopropylisoxazol-3-yl)-[3-[4-(4-fluorophenyl)piperazino]piperidino]methanone
1-{1-[(5-cyclopropyl-3-isoxazolyl)carbonyl]-3-piperidinyl}-4-(4-fluorophenyl)piperazine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 595.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 313.9±30.1 °C
Index of Refraction: 1.607
Molar Refractivity: 106.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.77
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 15.18
ACD/KOC (pH 7.4): 198.01
Polar Surface Area: 53 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 56.2±3.0 dyne/cm
Molar Volume: 309.2±3.0 cm3

Click to predict properties on the Chemicalize site


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