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Search term: GLPRVXBSUHOVMP-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 4-[2-(2,4-Difluorophenoxy)-5-(methylsulfonyl)phenyl]-N-ethyl-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide | C24H21F2N3O5S

4-[2-(2,4-Difluorophenoxy)-5-(methylsulfonyl)phenyl]-N-ethyl-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

  • Molecular FormulaC24H21F2N3O5S
  • Average mass501.502 Da
  • Monoisotopic mass501.117004 Da
  • ChemSpider ID76721410

More details:






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

1H-Pyrrolo[2,3-c]pyridine-2-carboxamide, 4-[2-(2,4-difluorophenoxy)-5-(methylsulfonyl)phenyl]-N-ethyl-6,7-dihydro-6-methyl-7-oxo- [ACD/Index Name]
4-[2-(2,4-Difluorophenoxy)-5-(methylsulfonyl)phenyl]-N-ethyl-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide [ACD/IUPAC Name]
4-[2-(2,4-Difluorophénoxy)-5-(méthylsulfonyl)phényl]-N-éthyl-6-méthyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridine-2-carboxamide [French] [ACD/IUPAC Name]
4-[2-(2,4-Difluorphenoxy)-5-(methylsulfonyl)phenyl]-N-ethyl-6-methyl-7-oxo-6,7-dihydro-1H-pyrrolo[2,3-c]pyridin-2-carboxamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 692.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.7±31.5 °C
Index of Refraction: 1.611
Molar Refractivity: 123.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.57
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 53.18
ACD/KOC (pH 5.5): 598.31
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 53.18
ACD/KOC (pH 7.4): 598.31
Polar Surface Area: 117 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 355.2±3.0 cm3

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