ChemSpider 2D Image | N-(4-{[5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-3,5-difluorophenyl)-1-propanesulfonamide | C23H18ClF2N3O3S

N-(4-{[5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-3,5-difluorophenyl)-1-propanesulfonamide

  • Molecular FormulaC23H18ClF2N3O3S
  • Average mass489.922 Da
  • Monoisotopic mass489.072540 Da
  • ChemSpider ID58967146

More details:






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

1-Propanesulfonamide, N-[4-[[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl]-3,5-difluorophenyl]- [ACD/Index Name]
N-(4-{[5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-3,5-difluorophenyl)-1-propanesulfonamide [ACD/IUPAC Name]
N-(4-{[5-(4-Chlorophényl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-3,5-difluorophényl)-1-propanesulfonamide [French] [ACD/IUPAC Name]
N-(4-{[5-(4-Chlorphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-3,5-difluorphenyl)-1-propansulfonamid [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 706.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 380.9±35.7 °C
Index of Refraction: 1.653
Molar Refractivity: 121.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.00
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 776.31
ACD/KOC (pH 5.5): 2999.16
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 36.99
ACD/KOC (pH 7.4): 142.90
Polar Surface Area: 100 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 332.4±3.0 cm3

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