ChemSpider 2D Image | N-(2-Fluorobenzyl)-2-({3-[(E)-2-(2-pyridinyl)vinyl]-1H-indazol-6-yl}amino)benzamide | C28H22FN5O

N-(2-Fluorobenzyl)-2-({3-[(E)-2-(2-pyridinyl)vinyl]-1H-indazol-6-yl}amino)benzamide

  • Molecular FormulaC28H22FN5O
  • Average mass463.506 Da
  • Monoisotopic mass463.180847 Da
  • ChemSpider ID76723624

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzamide, N-[(2-fluorophenyl)methyl]-2-[[3-[(E)-2-(2-pyridinyl)ethenyl]-1H-indazol-6-yl]amino]- [ACD/Index Name]
N-(2-Fluorbenzyl)-2-({3-[(E)-2-(2-pyridinyl)vinyl]-1H-indazol-6-yl}amino)benzamid [German] [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-({3-[(E)-2-(2-pyridinyl)vinyl]-1H-indazol-6-yl}amino)benzamide [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-({3-[(E)-2-(2-pyridinyl)vinyl]-1H-indazol-6-yl}amino)benzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 748.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 406.2±32.9 °C
Index of Refraction: 1.749
Molar Refractivity: 139.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5670.19
ACD/KOC (pH 5.5): 16414.12
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6301.19
ACD/KOC (pH 7.4): 18240.75
Polar Surface Area: 83 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 66.6±3.0 dyne/cm
Molar Volume: 342.8±3.0 cm3

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