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Search term: WCWDBZHYAHZGNZ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 1-[5-(Imidazo[1,2-a]pyrazin-3-ylethynyl)-1-methyl-1H-pyrazol-3-yl]-3-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl}urea | C26H26F3N9O

1-[5-(Imidazo[1,2-a]pyrazin-3-ylethynyl)-1-methyl-1H-pyrazol-3-yl]-3-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl}urea

  • Molecular FormulaC26H26F3N9O
  • Average mass537.539 Da
  • Monoisotopic mass537.221252 Da
  • ChemSpider ID29411732

More details:

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

1-[5-(Imidazo[1,2-a]pyrazin-3-ylethinyl)-1-methyl-1H-pyrazol-3-yl]-3-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluormethyl)phenyl}harnstoff [German] [ACD/IUPAC Name]
1-[5-(Imidazo[1,2-a]pyrazin-3-ylethynyl)-1-methyl-1H-pyrazol-3-yl]-3-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl}urea [ACD/IUPAC Name]
1-[5-(Imidazo[1,2-a]pyrazin-3-yléthynyl)-1-méthyl-1H-pyrazol-3-yl]-3-{4-[(4-méthyl-1-pipérazinyl)méthyl]-3-(trifluorométhyl)phényl}urée [French] [ACD/IUPAC Name]
Urea, N-[5-(2-imidazo[1,2-a]pyrazin-3-ylethynyl)-1-methyl-1H-pyrazol-3-yl]-N'-[4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.657
Molar Refractivity: 141.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.99
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 24.23
ACD/KOC (pH 7.4): 263.15
Polar Surface Area: 96 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 50.8±7.0 dyne/cm
Molar Volume: 384.2±7.0 cm3

Click to predict properties on the Chemicalize site


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