Found 49 results

Search term: MF = 'C_{31}H_{32}N_{8}'
ChemSpider 2D Image | N-(4-Benzylphenyl)-6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine | C31H32N8

N-(4-Benzylphenyl)-6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine

  • Molecular FormulaC31H32N8
  • Average mass516.639 Da
  • Monoisotopic mass516.274963 Da
  • ChemSpider ID121596935

More details:

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

4-Pyrimidinamine, 6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-N-[4-(phenylmethyl)phenyl]-2-(3-pyridinyl)- [ACD/Index Name]
N-(4-Benzylphenyl)-6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamin [German] [ACD/IUPAC Name]
N-(4-Benzylphenyl)-6-[4-(1,5-dimethyl-1H-1,2,4-triazol-3-yl)-1-piperidinyl]-2-(3-pyridinyl)-4-pyrimidinamine [ACD/IUPAC Name]
N-(4-Benzylphényl)-6-[4-(1,5-diméthyl-1H-1,2,4-triazol-3-yl)-1-pipéridinyl]-2-(3-pyridinyl)-4-pyrimidinamine [French] [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: 698.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.3±3.0 kJ/mol
Flash Point: 376.4±34.3 °C
Index of Refraction: 1.691
Molar Refractivity: 156.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 89.68
ACD/KOC (pH 5.5): 424.55
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 978.15
ACD/KOC (pH 7.4): 4630.48
Polar Surface Area: 85 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 51.8±7.0 dyne/cm
Molar Volume: 407.9±7.0 cm3

Click to predict properties on the Chemicalize site


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