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Search term: YZAHMIZAOIVVEF-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-{5-[(4-Acetyl-1-piperazinyl)methyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)-2(1H)-quinolinone | C27H26N6O2

3-{5-[(4-Acetyl-1-piperazinyl)methyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)-2(1H)-quinolinone

  • Molecular FormulaC27H26N6O2
  • Average mass466.534 Da
  • Monoisotopic mass466.211731 Da
  • ChemSpider ID23279819

More details:

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

2(1H)-Quinolinone, 3-[5-[(4-acetyl-1-piperazinyl)methyl]-1H-indol-2-yl]-6-(1H-pyrazol-4-yl)- [ACD/Index Name]
3-{5-[(4-Acetyl-1-piperazinyl)methyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)-2(1H)-chinolinon [German] [ACD/IUPAC Name]
3-{5-[(4-Acétyl-1-pipérazinyl)méthyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
3-{5-[(4-Acetyl-1-piperazinyl)methyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)-2(1H)-quinolinone [ACD/IUPAC Name]
3-{5-[(4-acetylpiperazin-1-yl)methyl]-1H-indol-2-yl}-6-(1H-pyrazol-4-yl)quinolin-2(1H)-one
3-(5-((4-acetylpiperazin-1-yl)methyl)-1H-indol-2-yl)-6-(1H-pyrazol-4-yl)quinolin-2(1H)-one
CHEMBL220653

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

Density: 1.4±0.1 g/cm3
Boiling Point: 846.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 123.0±3.0 kJ/mol
Flash Point: 465.8±34.3 °C
Index of Refraction: 1.705
Molar Refractivity: 133.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 1.33
ACD/BCF (pH 5.5): 3.35
ACD/KOC (pH 5.5): 40.99
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 34.78
ACD/KOC (pH 7.4): 425.31
Polar Surface Area: 97 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 68.9±3.0 dyne/cm
Molar Volume: 342.2±3.0 cm3

Click to predict properties on the Chemicalize site


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