ChemSpider 2D Image | N-(3-{[2-(3-Hydroxypropyl)-5-methoxyphenyl]amino}-2-quinoxalinyl)-1-methyl-2-[(methylsulfonyl)methyl]-1H-imidazole-4-sulfonamide | C24H28N6O6S2

N-(3-{[2-(3-Hydroxypropyl)-5-methoxyphenyl]amino}-2-quinoxalinyl)-1-methyl-2-[(methylsulfonyl)methyl]-1H-imidazole-4-sulfonamide

  • Molecular FormulaC24H28N6O6S2
  • Average mass560.646 Da
  • Monoisotopic mass560.151184 Da
  • ChemSpider ID34960826

More details:

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

1H-Imidazole-4-sulfonamide, N-[3-[[2-(3-hydroxypropyl)-5-methoxyphenyl]amino]-2-quinoxalinyl]-1-methyl-2-[(methylsulfonyl)methyl]- [ACD/Index Name]
N-(3-{[2-(3-Hydroxypropyl)-5-methoxyphenyl]amino}-2-chinoxalinyl)-1-methyl-2-[(methylsulfonyl)methyl]-1H-imidazol-4-sulfonamid [German] [ACD/IUPAC Name]
N-(3-{[2-(3-Hydroxypropyl)-5-methoxyphenyl]amino}-2-quinoxalinyl)-1-methyl-2-[(methylsulfonyl)methyl]-1H-imidazole-4-sulfonamide [ACD/IUPAC Name]
N-(3-{[2-(3-Hydroxypropyl)-5-méthoxyphényl]amino}-2-quinoxalinyl)-1-méthyl-2-[(méthylsulfonyl)méthyl]-1H-imidazole-4-sulfonamide [French] [ACD/IUPAC Name]
US8614215, 76

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

Density: 1.5±0.1 g/cm3
Boiling Point: 822.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.3±3.0 kJ/mol
Flash Point: 451.0±37.1 °C
Index of Refraction: 1.678
Molar Refractivity: 143.4±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 0.63
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 25.58
ACD/KOC (pH 5.5): 323.65
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 18.57
Polar Surface Area: 182 Å2
Polarizability: 56.8±0.5 10-24cm3
Surface Tension: 60.2±7.0 dyne/cm
Molar Volume: 380.4±7.0 cm3

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