ChemSpider 2D Image | 1-{1-Ethyl-3-[(4-phenyl-1-piperazinyl)carbonyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(1H-indazol-1-yl)ethanone | C28H31N7O2

1-{1-Ethyl-3-[(4-phenyl-1-piperazinyl)carbonyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(1H-indazol-1-yl)ethanone

  • Molecular FormulaC28H31N7O2
  • Average mass497.591 Da
  • Monoisotopic mass497.253937 Da
  • ChemSpider ID22143390

More details:

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

1-{1-Ethyl-3-[(4-phenyl-1-piperazinyl)carbonyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(1H-indazol-1-yl)ethanon [German] [ACD/IUPAC Name]
1-{1-Ethyl-3-[(4-phenyl-1-piperazinyl)carbonyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(1H-indazol-1-yl)ethanone [ACD/IUPAC Name]
1-{1-Éthyl-3-[(4-phényl-1-pipérazinyl)carbonyl]-1,4,6,7-tétrahydro-5H-pyrazolo[4,3-c]pyridin-5-yl}-2-(1H-indazol-1-yl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[1-ethyl-1,4,6,7-tetrahydro-3-[(4-phenyl-1-piperazinyl)carbonyl]-5H-pyrazolo[4,3-c]pyridin-5-yl]-2-(1H-indazol-1-yl)- [ACD/Index Name]
1-ethyl-5-(1H-indazol-1-ylacetyl)-3-[(4-phenyl-1-piperazinyl)carbonyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 782.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.9±3.0 kJ/mol
Flash Point: 427.1±32.9 °C
Index of Refraction: 1.708
Molar Refractivity: 143.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.99
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.05
ACD/KOC (pH 5.5): 387.91
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.09
ACD/KOC (pH 7.4): 388.45
Polar Surface Area: 80 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 58.7±7.0 dyne/cm
Molar Volume: 368.7±7.0 cm3

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