Found 49 results

Search term: MF = 'C_{31}H_{32}N_{8}'
ChemSpider 2D Image | N-{2-Benzyl-6-[4-(3-methyl-4H-1,2,4-triazol-4-yl)-1-piperidinyl]-4-pyrimidinyl}-N'-phenyl-1,4-benzenediamine | C31H32N8

N-{2-Benzyl-6-[4-(3-methyl-4H-1,2,4-triazol-4-yl)-1-piperidinyl]-4-pyrimidinyl}-N'-phenyl-1,4-benzenediamine

  • Molecular FormulaC31H32N8
  • Average mass516.639 Da
  • Monoisotopic mass516.274963 Da
  • ChemSpider ID121399690

More details:

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

1,4-Benzenediamine, N1-[6-[4-(3-methyl-4H-1,2,4-triazol-4-yl)-1-piperidinyl]-2-(phenylmethyl)-4-pyrimidinyl]-N4-phenyl- [ACD/Index Name]
N-{2-Benzyl-6-[4-(3-methyl-4H-1,2,4-triazol-4-yl)-1-piperidinyl]-4-pyrimidinyl}-N'-phenyl-1,4-benzenediamine [ACD/IUPAC Name]
N-{2-Benzyl-6-[4-(3-méthyl-4H-1,2,4-triazol-4-yl)-1-pipéridinyl]-4-pyrimidinyl}-N'-phényl-1,4-benzènediamine [French] [ACD/IUPAC Name]
N-{2-Benzyl-6-[4-(3-methyl-4H-1,2,4-triazol-4-yl)-1-piperidinyl]-4-pyrimidinyl}-N'-phenyl-1,4-benzoldiamin [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: 781.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±3.0 kJ/mol
Flash Point: 426.2±35.7 °C
Index of Refraction: 1.690
Molar Refractivity: 156.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 8.61
ACD/KOC (pH 5.5): 40.36
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 301.35
ACD/KOC (pH 7.4): 1411.68
Polar Surface Area: 84 Å2
Polarizability: 61.9±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 408.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement