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Search term: NQJSKCQFFYPSBX (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-(4-Chlorophenyl)-4-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine | C27H25ClN6

2-(4-Chlorophenyl)-4-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine

  • Molecular FormulaC27H25ClN6
  • Average mass468.981 Da
  • Monoisotopic mass468.182922 Da
  • ChemSpider ID67823053

More details:

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

2-(4-Chlorophenyl)-4-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine [ACD/IUPAC Name]
2-(4-Chlorophényl)-4-[4-(6-phényl-3-pyridazinyl)-1-pipérazinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidine [French] [ACD/IUPAC Name]
2-(4-Chlorphenyl)-4-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin [German] [ACD/IUPAC Name]
5H-Cyclopenta[d]pyrimidine, 2-(4-chlorophenyl)-6,7-dihydro-4-[4-(6-phenyl-3-pyridazinyl)-1-piperazinyl]- [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: 668.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.2±3.0 kJ/mol
Flash Point: 357.9±31.5 °C
Index of Refraction: 1.658
Molar Refractivity: 133.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 582.69
ACD/KOC (pH 5.5): 1754.04
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5174.80
ACD/KOC (pH 7.4): 15577.41
Polar Surface Area: 58 Å2
Polarizability: 52.8±0.5 10-24cm3
Surface Tension: 61.3±3.0 dyne/cm
Molar Volume: 361.5±3.0 cm3

Click to predict properties on the Chemicalize site


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