ChemSpider 2D Image | N~2~-[(3,5-Difluorophenyl)acetyl]-N-(1-{2-[3-(2-pyridinyl)-1-pyrrolidinyl]ethyl}-1H-imidazol-4-yl)-L-norvalinamide | C27H32F2N6O2

N2-[(3,5-Difluorophenyl)acetyl]-N-(1-{2-[3-(2-pyridinyl)-1-pyrrolidinyl]ethyl}-1H-imidazol-4-yl)-L-norvalinamide

  • Molecular FormulaC27H32F2N6O2
  • Average mass510.579 Da
  • Monoisotopic mass510.255493 Da
  • ChemSpider ID17270327

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Benzeneacetamide, 3,5-difluoro-N-[(1S)-1-[[[1-[2-[3-(2-pyridinyl)-1-pyrrolidinyl]ethyl]-1H-imidazol-4-yl]amino]carbonyl]butyl]- [ACD/Index Name]
N2-[(3,5-Difluorophenyl)acetyl]-N-(1-{2-[3-(2-pyridinyl)-1-pyrrolidinyl]ethyl}-1H-imidazol-4-yl)-L-norvalinamide [ACD/IUPAC Name]
N2-[(3,5-Difluorphenyl)acetyl]-N-(1-{2-[3-(2-pyridinyl)-1-pyrrolidinyl]ethyl}-1H-imidazol-4-yl)-L-norvalinamid [German] [ACD/IUPAC Name]
N2-[2-(3,5-Difluorophényl)acétyl]-N-(1-{2-[3-(2-pyridinyl)-1-pyrrolidinyl]éthyl}-1H-imidazol-4-yl)-L-norvalinamide [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: 790.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.0±3.0 kJ/mol
Flash Point: 432.1±32.9 °C
Index of Refraction: 1.622
Molar Refractivity: 138.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.76
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 2.68
ACD/KOC (pH 7.4): 29.54
Polar Surface Area: 92 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 392.5±7.0 cm3

Click to predict properties on the Chemicalize site


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