Found 54 results

Search term: MF = 'C_{25}H_{27}ClN_{8}'
ChemSpider 2D Image | 2-Benzyl-N-(4-chlorophenyl)-6-[4-(4,5-dimethyl-4H-1,2,4-triazol-3-yl)-1-piperazinyl]-4-pyrimidinamine | C25H27ClN8

2-Benzyl-N-(4-chlorophenyl)-6-[4-(4,5-dimethyl-4H-1,2,4-triazol-3-yl)-1-piperazinyl]-4-pyrimidinamine

  • Molecular FormulaC25H27ClN8
  • Average mass474.988 Da
  • Monoisotopic mass474.204712 Da
  • ChemSpider ID121359756

More details:

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

2-Benzyl-N-(4-chlorophenyl)-6-[4-(4,5-dimethyl-4H-1,2,4-triazol-3-yl)-1-piperazinyl]-4-pyrimidinamine [ACD/IUPAC Name]
2-Benzyl-N-(4-chlorophényl)-6-[4-(4,5-diméthyl-4H-1,2,4-triazol-3-yl)-1-pipérazinyl]-4-pyrimidinamine [French] [ACD/IUPAC Name]
2-Benzyl-N-(4-chlorphenyl)-6-[4-(4,5-dimethyl-4H-1,2,4-triazol-3-yl)-1-piperazinyl]-4-pyrimidinamin [German] [ACD/IUPAC Name]
4-Pyrimidinamine, N-(4-chlorophenyl)-6-[4-(4,5-dimethyl-4H-1,2,4-triazol-3-yl)-1-piperazinyl]-2-(phenylmethyl)- [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: 709.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.8±3.0 kJ/mol
Flash Point: 383.1±35.7 °C
Index of Refraction: 1.693
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 9.59
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 493.62
ACD/KOC (pH 7.4): 2275.23
Polar Surface Area: 75 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 53.3±7.0 dyne/cm
Molar Volume: 355.5±7.0 cm3

Click to predict properties on the Chemicalize site


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