ChemSpider 2D Image | N-(2-Methoxyethyl)-2-[(2-{[2-methoxy-4-(4-morpholinyl)phenyl]amino}-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]benzenesulfonamide | C26H33N7O5S

N-(2-Methoxyethyl)-2-[(2-{[2-methoxy-4-(4-morpholinyl)phenyl]amino}-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]benzenesulfonamide

  • Molecular FormulaC26H33N7O5S
  • Average mass555.649 Da
  • Monoisotopic mass555.226379 Da
  • ChemSpider ID61732924

More details:

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

Benzenesulfonamide, 2-[[6,7-dihydro-2-[[2-methoxy-4-(4-morpholinyl)phenyl]amino]-5H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-N-(2-methoxyethyl)- [ACD/Index Name]
N-(2-Methoxyethyl)-2-[(2-{[2-methoxy-4-(4-morpholinyl)phenyl]amino}-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]benzenesulfonamide [ACD/IUPAC Name]
N-(2-Méthoxyéthyl)-2-[(2-{[2-méthoxy-4-(4-morpholinyl)phényl]amino}-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]benzènesulfonamide [French] [ACD/IUPAC Name]
N-(2-Methoxyethyl)-2-[(2-{[2-methoxy-4-(4-morpholinyl)phenyl]amino}-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]benzolsulfonamid [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: 786.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 429.5±35.7 °C
Index of Refraction: 1.633
Molar Refractivity: 146.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.31
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 22.43
ACD/KOC (pH 5.5): 193.53
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 127.17
ACD/KOC (pH 7.4): 1097.16
Polar Surface Area: 147 Å2
Polarizability: 58.1±0.5 10-24cm3
Surface Tension: 62.4±3.0 dyne/cm
Molar Volume: 410.4±3.0 cm3

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