ChemSpider 2D Image | 4-[({4-[(2-Hydroxyethyl)(methyl)amino]-6-[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)amino]-1,3,5-triazin-2-yl}amino)methyl]benzenesulfonamide | C22H24N8O5S

4-[({4-[(2-Hydroxyethyl)(methyl)amino]-6-[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)amino]-1,3,5-triazin-2-yl}amino)methyl]benzenesulfonamide

  • Molecular FormulaC22H24N8O5S
  • Average mass512.542 Da
  • Monoisotopic mass512.159058 Da
  • ChemSpider ID124659365

More details:

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

4-[({4-[(2-Hydroxyethyl)(methyl)amino]-6-[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)amino]-1,3,5-triazin-2-yl}amino)methyl]benzenesulfonamide [ACD/IUPAC Name]
4-[({4-[(2-Hydroxyéthyl)(méthyl)amino]-6-[(2-méthyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)amino]-1,3,5-triazin-2-yl}amino)méthyl]benzènesulfonamide [French] [ACD/IUPAC Name]
4-[({4-[(2-Hydroxyethyl)(methyl)amino]-6-[(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)amino]-1,3,5-triazin-2-yl}amino)methyl]benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[[4-[(2,3-dihydro-2-methyl-1,3-dioxo-1H-isoindol-5-yl)amino]-6-[(2-hydroxyethyl)methylamino]-1,3,5-triazin-2-yl]amino]methyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 813.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.0±3.0 kJ/mol
Flash Point: 446.0±37.1 °C
Index of Refraction: 1.713
Molar Refractivity: 129.2±0.4 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -1.25
ACD/LogD (pH 5.5): 0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.49
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.28
Polar Surface Area: 192 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 94.1±3.0 dyne/cm
Molar Volume: 329.4±3.0 cm3

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