ChemSpider 2D Image | 1-[3-({3-Cyano-4-[(2,4-dichloro-5-methoxyphenyl)imino]-6-methoxy-1,4-dihydro-7-quinolinyl}oxy)propyl]-4-methylpiperazin-1-ium | C26H30Cl2N5O3

1-[3-({3-Cyano-4-[(2,4-dichloro-5-methoxyphenyl)imino]-6-methoxy-1,4-dihydro-7-quinolinyl}oxy)propyl]-4-methylpiperazin-1-ium

  • Molecular FormulaC26H30Cl2N5O3
  • Average mass531.454 Da
  • Monoisotopic mass530.171997 Da
  • ChemSpider ID21239678

  • Charge - Charge

More details:

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

1-[3-({3-Cyan-4-[(2,4-dichlor-5-methoxyphenyl)imino]-6-methoxy-1,4-dihydro-7-chinolinyl}oxy)propyl]-4-methylpiperazin-1-ium [German] [ACD/IUPAC Name]
1-[3-({3-Cyano-4-[(2,4-dichloro-5-méthoxyphényl)imino]-6-méthoxy-1,4-dihydro-7-quinoléinyl}oxy)propyl]-4-méthylpipérazin-1-ium [French] [ACD/IUPAC Name]
1-[3-({3-Cyano-4-[(2,4-dichloro-5-methoxyphenyl)imino]-6-methoxy-1,4-dihydro-7-quinolinyl}oxy)propyl]-4-methylpiperazin-1-ium [ACD/IUPAC Name]
3-Quinolinecarbonitrile, 4-[(2,4-dichloro-5-methoxyphenyl)imino]-1,4-dihydro-6-methoxy-7-[3-(4-methyl-1-piperazinyl)propoxy]-, conjugate monoacid [ACD/Index Name]

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

Density:
Boiling Point: 652.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.4±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 118.94
ACD/KOC (pH 7.4): 609.93
Polar Surface Area: 84 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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