ChemSpider 2D Image | N-[4-(4-Aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-2-butoxy-5-(2-methyl-2-butanyl)benzenesulfonamide | C27H32N4O3S2

N-[4-(4-Aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-2-butoxy-5-(2-methyl-2-butanyl)benzenesulfonamide

  • Molecular FormulaC27H32N4O3S2
  • Average mass524.698 Da
  • Monoisotopic mass524.191589 Da
  • ChemSpider ID24808332

More details:

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

Benzenesulfonamide, N-[4-(4-aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-2-butoxy-5-(1,1-dimethylpropyl)- [ACD/Index Name]
N-[4-(4-Aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-2-butoxy-5-(2-methyl-2-butanyl)benzenesulfonamide [ACD/IUPAC Name]
N-[4-(4-Aminothiéno[2,3-d]pyrimidin-5-yl)phényl]-2-butoxy-5-(2-méthyl-2-butanyl)benzènesulfonamide [French] [ACD/IUPAC Name]
N-[4-(4-Aminothieno[2,3-d]pyrimidin-5-yl)phenyl]-2-butoxy-5-(2-methyl-2-butanyl)benzolsulfonamid [German] [ACD/IUPAC Name]
Kinome_3638

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

Density: 1.3±0.1 g/cm3
Boiling Point: 713.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 385.5±35.7 °C
Index of Refraction: 1.630
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.40
ACD/LogD (pH 5.5): 6.11
ACD/BCF (pH 5.5): 24376.11
ACD/KOC (pH 5.5): 44389.84
ACD/LogD (pH 7.4): 6.03
ACD/BCF (pH 7.4): 20357.63
ACD/KOC (pH 7.4): 37072.04
Polar Surface Area: 144 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 412.9±3.0 cm3

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