Found 1 result

Search term: PJNPAVYZHHPABL-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-[1-(1-Benzyl-3-pyrrolidinyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indazole | C27H24FN5

5-[1-(1-Benzyl-3-pyrrolidinyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indazole

  • Molecular FormulaC27H24FN5
  • Average mass437.511 Da
  • Monoisotopic mass437.201569 Da
  • ChemSpider ID26386121

More details:

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

1H-Indazole, 5-[4-(4-fluorophenyl)-1-[1-(phenylmethyl)-3-pyrrolidinyl]-1H-imidazol-5-yl]- [ACD/Index Name]
5-[1-(1-Benzyl-3-pyrrolidinyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl]-1H-indazole [ACD/IUPAC Name]
5-[1-(1-Benzyl-3-pyrrolidinyl)-4-(4-fluorophényl)-1H-imidazol-5-yl]-1H-indazole [French] [ACD/IUPAC Name]
5-[1-(1-Benzyl-3-pyrrolidinyl)-4-(4-fluorphenyl)-1H-imidazol-5-yl]-1H-indazol [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: 655.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 350.1±31.5 °C
Index of Refraction: 1.696
Molar Refractivity: 128.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 4.33
ACD/KOC (pH 5.5): 14.26
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 197.36
ACD/KOC (pH 7.4): 649.10
Polar Surface Area: 50 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 334.4±7.0 cm3

Click to predict properties on the Chemicalize site


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