ChemSpider 2D Image | 2-[(4-Isopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(4-phenyl-1-piperazinyl)ethanone | C26H28N6OS

2-[(4-Isopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(4-phenyl-1-piperazinyl)ethanone

  • Molecular FormulaC26H28N6OS
  • Average mass472.605 Da
  • Monoisotopic mass472.204529 Da
  • ChemSpider ID22528690

More details:

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

2-[(4-Isopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(4-phenyl-1-piperazinyl)ethanon [German] [ACD/IUPAC Name]
2-[(4-Isopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(4-phenyl-1-piperazinyl)ethanone [ACD/IUPAC Name]
2-[(4-Isopropyl-1-phényl-1H-pyrazolo[3,4-d]pyridazin-7-yl)sulfanyl]-1-(4-phényl-1-pipérazinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[[4-(1-methylethyl)-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl]thio]-1-(4-phenyl-1-piperazinyl)- [ACD/Index Name]
1105235-43-5 [RN]
2-((4-isopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyridazin-7-yl)thio)-1-(4-phenylpiperazin-1-yl)ethanone
2-{[1-phenyl-4-(propan-2-yl)-1H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}-1-(4-phenylpiperazin-1-yl)ethan-1-one

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

Density: 1.3±0.1 g/cm3
Boiling Point: 676.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.4±3.0 kJ/mol
Flash Point: 363.1±31.5 °C
Index of Refraction: 1.687
Molar Refractivity: 139.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 567.54
ACD/KOC (pH 5.5): 3251.73
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 571.17
ACD/KOC (pH 7.4): 3272.56
Polar Surface Area: 92 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 364.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement