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Search term: CCCCCCNc1cc(NCc2cccnc2)c(cc1[N+]([O-])=O)C(N)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 4-(Hexylamino)-5-nitro-2-[(3-pyridinylmethyl)amino]benzamide | C19H25N5O3

4-(Hexylamino)-5-nitro-2-[(3-pyridinylmethyl)amino]benzamide

  • Molecular FormulaC19H25N5O3
  • Average mass371.434 Da
  • Monoisotopic mass371.195740 Da
  • ChemSpider ID35033810

More details:

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

4-(Hexylamino)-5-nitro-2-[(3-pyridinylmethyl)amino]benzamid [German] [ACD/IUPAC Name]
4-(Hexylamino)-5-nitro-2-[(3-pyridinylmethyl)amino]benzamide [ACD/IUPAC Name]
4-(Hexylamino)-5-nitro-2-[(3-pyridinylméthyl)amino]benzamide [French] [ACD/IUPAC Name]
4-(hexylamino)-5-nitro-2-[(pyridin-3-ylmethyl)amino]benzamide
Benzamide, 4-(hexylamino)-5-nitro-2-[(3-pyridinylmethyl)amino]- [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: 545.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.4±30.1 °C
Index of Refraction: 1.642
Molar Refractivity: 106.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2184.16
ACD/KOC (pH 5.5): 8159.33
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2566.79
ACD/KOC (pH 7.4): 9588.74
Polar Surface Area: 126 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 295.3±3.0 cm3

Click to predict properties on the Chemicalize site


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