ChemSpider 2D Image | 5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}-N-[3-(4-methyl-1-piperazinyl)phenyl][1,2,4]triazolo[1,5-a]pyridin-2-amine | C28H33N7O2S

5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}-N-[3-(4-methyl-1-piperazinyl)phenyl][1,2,4]triazolo[1,5-a]pyridin-2-amine

  • Molecular FormulaC28H33N7O2S
  • Average mass531.672 Da
  • Monoisotopic mass531.241638 Da
  • ChemSpider ID34951924

More details:

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

[1,2,4]Triazolo[1,5-a]pyridin-2-amine, 5-[4-[(1,1-dioxido-4-thiomorpholinyl)methyl]phenyl]-N-[3-(4-methyl-1-piperazinyl)phenyl]- [ACD/Index Name]
5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}-N-[3-(4-methyl-1-piperazinyl)phenyl][1,2,4]triazolo[1,5-a]pyridin-2-amin [German] [ACD/IUPAC Name]
5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}-N-[3-(4-methyl-1-piperazinyl)phenyl][1,2,4]triazolo[1,5-a]pyridin-2-amine [ACD/IUPAC Name]
5-{4-[(1,1-Dioxydo-4-thiomorpholinyl)méthyl]phényl}-N-[3-(4-méthyl-1-pipérazinyl)phényl][1,2,4]triazolo[1,5-a]pyridin-2-amine [French] [ACD/IUPAC Name]
US8501936, 71

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: 1.705
Molar Refractivity: 150.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.02
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 16.73
ACD/KOC (pH 7.4): 206.15
Polar Surface Area: 94 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 59.0±7.0 dyne/cm
Molar Volume: 388.3±7.0 cm3

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