ChemSpider 2D Image | 1,5,6,7-Tetrahydro-1-methyl-2-[2-[[5-(4-methyl-1-piperazinyl)-2-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]-4H-pyrrolo[3,2-c]pyridin-4-one | C24H26F3N7O2

1,5,6,7-Tetrahydro-1-methyl-2-[2-[[5-(4-methyl-1-piperazinyl)-2-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]-4H-pyrrolo[3,2-c]pyridin-4-one

  • Molecular FormulaC24H26F3N7O2
  • Average mass501.504 Da
  • Monoisotopic mass501.210022 Da
  • ChemSpider ID26325918

More details:






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

1,5,6,7-Tetrahydro-1-methyl-2-[2-[[5-(4-methyl-1-piperazinyl)-2-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]-4H-pyrrolo[3,2-c]pyridin-4-one
1137825-76-3 [RN]
1-Methyl-2-(2-{[5-(4-methyl-1-piperazinyl)-2-(trifluormethoxy)phenyl]amino}-4-pyrimidinyl)-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-on [German] [ACD/IUPAC Name]
1-Methyl-2-(2-{[5-(4-methyl-1-piperazinyl)-2-(trifluoromethoxy)phenyl]amino}-4-pyrimidinyl)-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one [ACD/IUPAC Name]
1-Méthyl-2-(2-{[5-(4-méthyl-1-pipérazinyl)-2-(trifluorométhoxy)phényl]amino}-4-pyrimidinyl)-1,5,6,7-tétrahydro-4H-pyrrolo[3,2-c]pyridin-4-one [French] [ACD/IUPAC Name]
1-Methyl-2-(2-{[5-(4-Methylpiperazin-1-Yl)-2-(Trifluoromethoxy)phenyl]amino}pyrimidin-4-Yl)-1,5,6,7-Tetrahydro-4h-Pyrrolo[3,2-C]pyridin-4-One
4H-Pyrrolo[3,2-c]pyridin-4-one, 1,5,6,7-tetrahydro-1-methyl-2-[2-[[5-(4-methyl-1-piperazinyl)-2-(trifluoromethoxy)phenyl]amino]-4-pyrimidinyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 126.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.75
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 24.30
ACD/KOC (pH 7.4): 283.90
Polar Surface Area: 88 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 343.2±7.0 cm3

Click to predict properties on the Chemicalize site






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