ChemSpider 2D Image | N-[(2R)-2-(Benzyloxy)cyclopentyl]-1-[3',5'-bis(trifluoromethyl)-4-biphenylyl]-1H-imidazole-5-carboxamide | C30H25F6N3O2

N-[(2R)-2-(Benzyloxy)cyclopentyl]-1-[3',5'-bis(trifluoromethyl)-4-biphenylyl]-1H-imidazole-5-carboxamide

  • Molecular FormulaC30H25F6N3O2
  • Average mass573.529 Da
  • Monoisotopic mass573.185120 Da
  • ChemSpider ID22839568

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

1H-Imidazole-5-carboxamide, 1-[3',5'-bis(trifluoromethyl)[1,1'-biphenyl]-4-yl]-N-[(2R)-2-(phenylmethoxy)cyclopentyl]- [ACD/Index Name]
N-[(2R)-2-(Benzyloxy)cyclopentyl]-1-[3',5'-bis(trifluormethyl)-4-biphenylyl]-1H-imidazol-5-carboxamid [German] [ACD/IUPAC Name]
N-[(2R)-2-(Benzyloxy)cyclopentyl]-1-[3',5'-bis(trifluoromethyl)-4-biphenylyl]-1H-imidazole-5-carboxamide [ACD/IUPAC Name]
N-[(2R)-2-(Benzyloxy)cyclopentyl]-1-[3',5'-bis(trifluorométhyl)-4-biphénylyl]-1H-imidazole-5-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 667.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 357.4±31.5 °C
Index of Refraction: 1.577
Molar Refractivity: 140.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.26
ACD/LogD (pH 5.5): 6.42
ACD/BCF (pH 5.5): 44360.55
ACD/KOC (pH 5.5): 73762.16
ACD/LogD (pH 7.4): 6.42
ACD/BCF (pH 7.4): 44385.21
ACD/KOC (pH 7.4): 73803.15
Polar Surface Area: 56 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 40.2±7.0 dyne/cm
Molar Volume: 424.2±7.0 cm3

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