ChemSpider 2D Image | (3E)-N,5-Bis(3,4-dichlorophenyl)-3-{[3-(diethylamino)propyl]imino}-3,5-dihydro-2-phenazinamine | C31H29Cl4N5

(3E)-N,5-Bis(3,4-dichlorophenyl)-3-{[3-(diethylamino)propyl]imino}-3,5-dihydro-2-phenazinamine

  • Molecular FormulaC31H29Cl4N5
  • Average mass613.407 Da
  • Monoisotopic mass611.117737 Da
  • ChemSpider ID408939

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-N,5-Bis(3,4-dichlorophenyl)-3-{[3-(diethylamino)propyl]imino}-3,5-dihydro-2-phenazinamine [ACD/IUPAC Name]
(3E)-N,5-Bis(3,4-dichlorophényl)-3-{[3-(diéthylamino)propyl]imino}-3,5-dihydro-2-phénazinamine [French] [ACD/IUPAC Name]
(3E)-N,5-Bis(3,4-dichlorphenyl)-3-{[3-(diethylamino)propyl]imino}-3,5-dihydro-2-phenazinamin [German] [ACD/IUPAC Name]
1,3-Propanediamine, N'-[(2E)-10-(3,4-dichlorophenyl)-3-[(3,4-dichlorophenyl)amino]-2(10H)-phenazinylidene]-N,N-diethyl-
1,3-Propanediamine, N3-[(2E)-10-(3,4-dichlorophenyl)-3-[(3,4-dichlorophenyl)amino]-2(10H)-phenazinylidene]-N1,N1-diethyl- [ACD/Index Name]
B4154
Clofazimine analogs

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

AIDS043825 [DBID]
AIDS-043825 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 664.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 355.6±31.5 °C
Index of Refraction: 1.651
Molar Refractivity: 167.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 9.19
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 421.10
ACD/KOC (pH 5.5): 180.40
ACD/LogD (pH 7.4): 5.48
ACD/BCF (pH 7.4): 1126.98
ACD/KOC (pH 7.4): 482.80
Polar Surface Area: 43 Å2
Polarizability: 66.5±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 459.4±7.0 cm3

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