ChemSpider 2D Image | 2-(3-Chlorophenyl)-4-(cyclopentyloxy)-5-{4-[(1-methyl-1H-indol-6-yl)sulfonyl]-1-piperazinyl}-3(2H)-pyridazinone | C28H30ClN5O4S

2-(3-Chlorophenyl)-4-(cyclopentyloxy)-5-{4-[(1-methyl-1H-indol-6-yl)sulfonyl]-1-piperazinyl}-3(2H)-pyridazinone

  • Molecular FormulaC28H30ClN5O4S
  • Average mass568.087 Da
  • Monoisotopic mass567.170715 Da
  • ChemSpider ID26340360

More details:

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

2-(3-Chlorophenyl)-4-(cyclopentyloxy)-5-{4-[(1-methyl-1H-indol-6-yl)sulfonyl]-1-piperazinyl}-3(2H)-pyridazinone [ACD/IUPAC Name]
2-(3-Chlorophényl)-4-(cyclopentyloxy)-5-{4-[(1-méthyl-1H-indol-6-yl)sulfonyl]-1-pipérazinyl}-3(2H)-pyridazinone [French] [ACD/IUPAC Name]
2-(3-Chlorphenyl)-4-(cyclopentyloxy)-5-{4-[(1-methyl-1H-indol-6-yl)sulfonyl]-1-piperazinyl}-3(2H)-pyridazinon [German] [ACD/IUPAC Name]
3(2H)-Pyridazinone, 2-(3-chlorophenyl)-4-(cyclopentyloxy)-5-[4-[(1-methyl-1H-indol-6-yl)sulfonyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 754.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 410.3±35.7 °C
Index of Refraction: 1.701
Molar Refractivity: 151.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.31
ACD/BCF (pH 5.5): 1102.51
ACD/KOC (pH 5.5): 5232.62
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 1107.95
ACD/KOC (pH 7.4): 5258.48
Polar Surface Area: 96 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 59.9±7.0 dyne/cm
Molar Volume: 391.9±7.0 cm3

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