ChemSpider 2D Image | GSK-1521498 | C24H20F2N4

GSK-1521498

  • Molecular FormulaC24H20F2N4
  • Average mass402.439 Da
  • Monoisotopic mass402.165588 Da
  • ChemSpider ID32701351

More details:

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

1007573-18-3 [RN]
1H-Inden-2-amine, N-[[3,5-difluoro-3'-(1H-1,2,4-triazol-3-yl)[1,1'-biphenyl]-4-yl]methyl]-2,3-dihydro- [ACD/Index Name]
GSK-1521498
N-((3,5-Difluoro-3'-(1H-1,2,4-triazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-2,3-dihydro-1H-inden-2-amine
N-{[3,5-Difluor-3'-(1H-1,2,4-triazol-3-yl)-4-biphenylyl]methyl}-2-indanamin [German] [ACD/IUPAC Name]
N-{[3,5-Difluoro-3'-(1H-1,2,4-triazol-3-yl)-4-biphenylyl]methyl}-2-indanamine [ACD/IUPAC Name]
N-{[3,5-Difluoro-3'-(1H-1,2,4-triazol-3-yl)-4-biphénylyl]méthyl}-2-indanamine [French] [ACD/IUPAC Name]
[1,1'-Biphenyl]-4-methanamine, N-(2,3-dihydro-1H-inden-2-yl)-3,5-difluoro-3'-(1H-1,2,4-triazol-5-yl)-
1007573-18-3 (free base)
GSK1521498
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

W0UTB622GK [DBID]
UNII:W0UTB622GK [DBID]
UNII-W0UTB622GK [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 606.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 320.9±34.3 °C
Index of Refraction: 1.668
Molar Refractivity: 110.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 3331.05
ACD/KOC (pH 5.5): 9873.49
ACD/LogD (pH 7.4): 5.25
ACD/BCF (pH 7.4): 5745.94
ACD/KOC (pH 7.4): 17031.40
Polar Surface Area: 54 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 65.2±5.0 dyne/cm
Molar Volume: 297.0±5.0 cm3

Click to predict properties on the Chemicalize site


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