ChemSpider 2D Image | N-(3-{[(5-Cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl}-2-pyridinyl)-N-methylmethanesulfonamide | C22H20N6O2S

N-(3-{[(5-Cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl}-2-pyridinyl)-N-methylmethanesulfonamide

  • Molecular FormulaC22H20N6O2S
  • Average mass432.498 Da
  • Monoisotopic mass432.136841 Da
  • ChemSpider ID29398011

More details:

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

Methanesulfonamide, N-[3-[[(5-cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl]-2-pyridinyl]-N-methyl- [ACD/Index Name]
N-(3-{[(5-Cyan-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl}-2-pyridinyl)-N-methylmethansulfonamid [German] [ACD/IUPAC Name]
N-(3-{[(5-Cyano-2-phenyl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]methyl}-2-pyridinyl)-N-methylmethanesulfonamide [ACD/IUPAC Name]
N-(3-{[(5-Cyano-2-phényl-1H-pyrrolo[2,3-b]pyridin-4-yl)amino]méthyl}-2-pyridinyl)-N-méthylméthanesulfonamide [French] [ACD/IUPAC Name]
N-(3-{[(5-Cyano-2-Phenyl-1h-Pyrrolo[2,3-B]pyridin-4-Yl)amino]methyl}pyridin-2-Yl)-N-Methylmethanesulfonamide
10N

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.719
Molar Refractivity: 118.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 60.35
ACD/KOC (pH 5.5): 619.51
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.18
ACD/KOC (pH 7.4): 751.33
Polar Surface Area: 123 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 84.4±5.0 dyne/cm
Molar Volume: 299.3±5.0 cm3

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