ChemSpider 2D Image | (2E)-2-(4-Fluorobenzylidene)-1-[3-fluoro-4-({6-methoxy-7-[3-(4-methyl-1-piperidinyl)propoxy]-4-quinolinyl}oxy)phenyl]hydrazinecarboxamide | C33H35F2N5O4

(2E)-2-(4-Fluorobenzylidene)-1-[3-fluoro-4-({6-methoxy-7-[3-(4-methyl-1-piperidinyl)propoxy]-4-quinolinyl}oxy)phenyl]hydrazinecarboxamide

  • Molecular FormulaC33H35F2N5O4
  • Average mass603.659 Da
  • Monoisotopic mass603.265686 Da
  • ChemSpider ID128985052

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-(4-Fluorbenzyliden)-1-[3-fluor-4-({6-methoxy-7-[3-(4-methyl-1-piperidinyl)propoxy]-4-chinolinyl}oxy)phenyl]hydrazincarboxamid [German] [ACD/IUPAC Name]
(2E)-2-(4-Fluorobenzylidène)-1-[3-fluoro-4-({6-méthoxy-7-[3-(4-méthyl-1-pipéridinyl)propoxy]-4-quinoléinyl}oxy)phényl]hydrazinecarboxamide [French] [ACD/IUPAC Name]
(2E)-2-(4-Fluorobenzylidene)-1-[3-fluoro-4-({6-methoxy-7-[3-(4-methyl-1-piperidinyl)propoxy]-4-quinolinyl}oxy)phenyl]hydrazinecarboxamide [ACD/IUPAC Name]
Hydrazinecarboxamide, 1-[3-fluoro-4-[[6-methoxy-7-[3-(4-methyl-1-piperidinyl)propoxy]-4-quinolinyl]oxy]phenyl]-2-[(4-fluorophenyl)methylene]-, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 726.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 393.1±35.7 °C
Index of Refraction: 1.609
Molar Refractivity: 162.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.49
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 5.03
ACD/KOC (pH 5.5): 14.44
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 102.12
ACD/KOC (pH 7.4): 293.30
Polar Surface Area: 103 Å2
Polarizability: 64.3±0.5 10-24cm3
Surface Tension: 45.6±7.0 dyne/cm
Molar Volume: 468.8±7.0 cm3

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