ChemSpider 2D Image | 4-Amino-1-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)-1-butanone | C20H29F3N4O

4-Amino-1-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)-1-butanone

  • Molecular FormulaC20H29F3N4O
  • Average mass398.466 Da
  • Monoisotopic mass398.229340 Da
  • ChemSpider ID29731057

More details:

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

1-Butanone, 4-amino-1-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-1-piperidinyl]- [ACD/Index Name]
4-Amino-1-(3-{4-[3-(trifluormethyl)phenyl]-1-piperazinyl}-1-piperidinyl)-1-butanon [German] [ACD/IUPAC Name]
4-Amino-1-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)-1-butanone [ACD/IUPAC Name]
4-Amino-1-(3-{4-[3-(trifluorométhyl)phényl]-1-pipérazinyl}-1-pipéridinyl)-1-butanone [French] [ACD/IUPAC Name]
4-AMINO-1-(3-{4-[3-(TRIFLUOROMETHYL)PHENYL]PIPERAZIN-1-YL}PIPERIDIN-1-YL)BUTAN-1-ONE
4-oxo-4-(3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-piperidinyl)-1-butanamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 530.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 274.8±30.1 °C
Index of Refraction: 1.537
Molar Refractivity: 101.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): -1.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.54
Polar Surface Area: 53 Å2
Polarizability: 40.3±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 325.4±3.0 cm3

Click to predict properties on the Chemicalize site


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