ChemSpider 2D Image | (2E)-3-(4-Fluorophenyl)-N-(4-{2-[7-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]ethyl}cyclohexyl)acrylamide | C30H35FN4O2

(2E)-3-(4-Fluorophenyl)-N-(4-{2-[7-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]ethyl}cyclohexyl)acrylamide

  • Molecular FormulaC30H35FN4O2
  • Average mass502.623 Da
  • Monoisotopic mass502.274414 Da
  • ChemSpider ID13227332

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(4-Fluorophenyl)-N-(4-{2-[7-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]ethyl}cyclohexyl)acrylamide [ACD/IUPAC Name]
(2E)-3-(4-Fluorophényl)-N-(4-{2-[7-(5-méthyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tétrahydro-3H-3-benzazépin-3-yl]éthyl}cyclohexyl)acrylamide [French] [ACD/IUPAC Name]
(2E)-3-(4-Fluorphenyl)-N-(4-{2-[7-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]ethyl}cyclohexyl)acrylamid [German] [ACD/IUPAC Name]
2-Propenamide, 3-(4-fluorophenyl)-N-[4-[2-[1,2,4,5-tetrahydro-7-(5-methyl-1,2,4-oxadiazol-3-yl)-3H-3-benzazepin-3-yl]ethyl]cyclohexyl]-, (2E)- [ACD/Index Name]
(2E)-3-(4-fluorophenyl)-N-(4-{2-[7-(5-methyl-1,2,4-oxadiazol-3-yl)-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl]ethyl}cyclohexyl)prop-2-enamide
NOCAS_47326

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

Density: 1.2±0.0 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.611
Molar Refractivity: 141.9±0.0 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 7.66
ACD/KOC (pH 5.5): 22.95
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 249.60
ACD/KOC (pH 7.4): 748.38
Polar Surface Area: 71 Å2
Polarizability: 56.2±0.0 10-24cm3
Surface Tension: 57.7±0.0 dyne/cm
Molar Volume: 408.1±0.0 cm3

Click to predict properties on the Chemicalize site


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