ChemSpider 2D Image | N-[2-(Cyclohexyl{[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-4-fluoro-N-isopropylbenzamide | C30H35F2N3O2

N-[2-(Cyclohexyl{[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-4-fluoro-N-isopropylbenzamide

  • Molecular FormulaC30H35F2N3O2
  • Average mass507.615 Da
  • Monoisotopic mass507.269745 Da
  • ChemSpider ID1011439

More details:

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

Benzamide, N-[2-[cyclohexyl[[1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl]methyl]amino]-2-oxoethyl]-4-fluoro-N-(1-methylethyl)- [ACD/Index Name]
N-[2-(Cyclohexyl{[1-(4-fluorbenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-4-fluor-N-isopropylbenzamid [German] [ACD/IUPAC Name]
N-[2-(Cyclohexyl{[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]methyl}amino)-2-oxoethyl]-4-fluoro-N-isopropylbenzamide [ACD/IUPAC Name]
N-[2-(Cyclohexyl{[1-(4-fluorobenzyl)-1H-pyrrol-2-yl]méthyl}amino)-2-oxoéthyl]-4-fluoro-N-isopropylbenzamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 666.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 356.8±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 143.6±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.25
ACD/LogD (pH 5.5): 4.58
ACD/BCF (pH 5.5): 1773.39
ACD/KOC (pH 5.5): 7363.60
ACD/LogD (pH 7.4): 4.58
ACD/BCF (pH 7.4): 1773.39
ACD/KOC (pH 7.4): 7363.61
Polar Surface Area: 46 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 41.0±7.0 dyne/cm
Molar Volume: 431.8±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement