ChemSpider 2D Image | (2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-4-piperidinyl)-3-[2-(trifluoromethyl)phenyl]acrylamide | C32H32F3N3O2

(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-4-piperidinyl)-3-[2-(trifluoromethyl)phenyl]acrylamide

  • Molecular FormulaC32H32F3N3O2
  • Average mass547.611 Da
  • Monoisotopic mass547.244690 Da
  • ChemSpider ID9539756
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-4-piperidinyl)-3-[2-(trifluormethyl)phenyl]acrylamid [German] [ACD/IUPAC Name]
(2E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-4-piperidinyl)-3-[2-(trifluoromethyl)phenyl]acrylamide [ACD/IUPAC Name]
(2E)-N-(1-Acétyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-4-pipéridinyl)-3-[2-(trifluorométhyl)phényl]acrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-(1-acetyl-2,3-dihydro-1H-indol-6-yl)-N-[1-(phenylmethyl)-4-piperidinyl]-3-[2-(trifluoromethyl)phenyl]-, (2E)- [ACD/Index Name]
(2E)-N-(1-acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzylpiperidin-4-yl)-3-[2-(trifluoromethyl)phenyl]prop-2-enamide
(E)-N-(1-Acetyl-2,3-dihydro-1H-indol-6-yl)-N-(1-benzyl-piperidin-4-yl)-3-(2-trifluoromethyl-phenyl)-acrylamide
CHEMBL21545

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

Density: 1.3±0.1 g/cm3
Boiling Point: 689.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 370.5±31.5 °C
Index of Refraction: 1.623
Molar Refractivity: 150.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 3.28
ACD/BCF (pH 5.5): 64.31
ACD/KOC (pH 5.5): 198.26
ACD/LogD (pH 7.4): 4.87
ACD/BCF (pH 7.4): 2477.67
ACD/KOC (pH 7.4): 7638.68
Polar Surface Area: 44 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 426.7±3.0 cm3

Click to predict properties on the Chemicalize site






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