ChemSpider 2D Image | N-{[4-Methoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methyl}-4-(1H-pyrazol-1-yl)benzenesulfonamide | C18H21N7O4S

N-{[4-Methoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methyl}-4-(1H-pyrazol-1-yl)benzenesulfonamide

  • Molecular FormulaC18H21N7O4S
  • Average mass431.469 Da
  • Monoisotopic mass431.137573 Da
  • ChemSpider ID58211200

More details:






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

Benzenesulfonamide, N-[[4-methoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methyl]-4-(1H-pyrazol-1-yl)- [ACD/Index Name]
N-{[4-Methoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methyl}-4-(1H-pyrazol-1-yl)benzenesulfonamide [ACD/IUPAC Name]
N-{[4-Méthoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]méthyl}-4-(1H-pyrazol-1-yl)benzènesulfonamide [French] [ACD/IUPAC Name]
N-{[4-Methoxy-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methyl}-4-(1H-pyrazol-1-yl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-((4-methoxy-6-morpholino-1,3,5-triazin-2-yl)methyl)-4-(1H-pyrazol-1-yl)benzenesulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 672.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.7±3.0 kJ/mol
Flash Point: 360.3±34.3 °C
Index of Refraction: 1.704
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 7.05
ACD/KOC (pH 5.5): 139.14
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 2.74
ACD/KOC (pH 7.4): 54.14
Polar Surface Area: 133 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 64.4±7.0 dyne/cm
Molar Volume: 285.7±7.0 cm3

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