ChemSpider 2D Image | 6-[4-(2-Chlorophenyl)-1-piperazinyl]-N-(4-methoxyphenyl)-N'-(2-methylbenzyl)-1,3,5-triazine-2,4-diamine | C28H30ClN7O

6-[4-(2-Chlorophenyl)-1-piperazinyl]-N-(4-methoxyphenyl)-N'-(2-methylbenzyl)-1,3,5-triazine-2,4-diamine

  • Molecular FormulaC28H30ClN7O
  • Average mass516.037 Da
  • Monoisotopic mass515.220032 Da
  • ChemSpider ID124587964

More details:

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

1,3,5-Triazine-2,4-diamine, 6-[4-(2-chlorophenyl)-1-piperazinyl]-N2-(4-methoxyphenyl)-N4-[(2-methylphenyl)methyl]- [ACD/Index Name]
6-[4-(2-Chlorophenyl)-1-piperazinyl]-N-(4-methoxyphenyl)-N'-(2-methylbenzyl)-1,3,5-triazine-2,4-diamine [ACD/IUPAC Name]
6-[4-(2-Chlorophényl)-1-pipérazinyl]-N-(4-méthoxyphényl)-N'-(2-méthylbenzyl)-1,3,5-triazine-2,4-diamine [French] [ACD/IUPAC Name]
6-[4-(2-Chlorphenyl)-1-piperazinyl]-N-(4-methoxyphenyl)-N'-(2-methylbenzyl)-1,3,5-triazin-2,4-diamin [German] [ACD/IUPAC 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: 723.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 391.2±35.7 °C
Index of Refraction: 1.676
Molar Refractivity: 148.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 833.46
ACD/KOC (pH 5.5): 2716.83
ACD/LogD (pH 7.4): 5.04
ACD/BCF (pH 7.4): 3956.07
ACD/KOC (pH 7.4): 12895.55
Polar Surface Area: 78 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 65.1±3.0 dyne/cm
Molar Volume: 395.0±3.0 cm3

Click to predict properties on the Chemicalize site


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