ChemSpider 2D Image | Filgotinib-d4 | C21H19D4N5O3S

Filgotinib-d4

  • Molecular FormulaC21H19D4N5O3S
  • Average mass429.529 Da
  • Monoisotopic mass429.177277 Da
  • ChemSpider ID81407766

  • Non-standard isotope - Non-standard isotope

More details:

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

2041095-50-3 [RN]
Cyclopropane-2,2,3,3-d4-carboxamide, N-[5-[4-[(1,1-dioxido-4-thiomorpholinyl)methyl]phenyl][1,2,4]triazolo[1,5-a]pyridin-2-yl]- [ACD/Index Name]
Filgotinib-d4
N-(5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}[1,2,4]triazolo[1,5-a]pyridin-2-yl)(2,2,3,3-2H4)cyclopropancarboxamid [German] [ACD/IUPAC Name]
N-(5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}[1,2,4]triazolo[1,5-a]pyridin-2-yl)(2,2,3,3-2H4)cyclopropanecarboxamide [ACD/IUPAC Name]
N-(5-{4-[(1,1-Dioxydo-4-thiomorpholinyl)méthyl]phényl}[1,2,4]triazolo[1,5-a]pyridin-2-yl)(2,2,3,3-2H4)cyclopropanecarboxamide [French] [ACD/IUPAC Name]
N-[5-[4-[(1,1-dioxido-4-thiomorpholinyl)methyl]phenyl][1,2,4]triazolo[1,5-a]pyridin-2-yl]-cyclopropane-2,2,3,3-d4-carboxamide

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.748
Molar Refractivity: 114.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.79
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 2.92
ACD/KOC (pH 5.5): 72.07
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.74
ACD/KOC (pH 7.4): 67.62
Polar Surface Area: 105 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 67.4±7.0 dyne/cm
Molar Volume: 281.1±7.0 cm3

Click to predict properties on the Chemicalize site


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