ChemSpider 2D Image | N-Cyclohexyl-2-(3,5-dimethylphenyl)-N-ethyl-3-(2-{[4-(3-pyridinyl)butyl]amino}ethyl)-1H-indole-5-carboxamide | C36H46N4O

N-Cyclohexyl-2-(3,5-dimethylphenyl)-N-ethyl-3-(2-{[4-(3-pyridinyl)butyl]amino}ethyl)-1H-indole-5-carboxamide

  • Molecular FormulaC36H46N4O
  • Average mass550.777 Da
  • Monoisotopic mass550.367188 Da
  • ChemSpider ID23143003

More details:

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

1H-Indole-5-carboxamide, N-cyclohexyl-2-(3,5-dimethylphenyl)-N-ethyl-3-[2-[[4-(3-pyridinyl)butyl]amino]ethyl]- [ACD/Index Name]
N-Cyclohexyl-2-(3,5-dimethylphenyl)-N-ethyl-3-(2-{[4-(3-pyridinyl)butyl]amino}ethyl)-1H-indol-5-carboxamid [German] [ACD/IUPAC Name]
N-Cyclohexyl-2-(3,5-dimethylphenyl)-N-ethyl-3-(2-{[4-(3-pyridinyl)butyl]amino}ethyl)-1H-indole-5-carboxamide [ACD/IUPAC Name]
N-Cyclohexyl-2-(3,5-diméthylphényl)-N-éthyl-3-(2-{[4-(3-pyridinyl)butyl]amino}éthyl)-1H-indole-5-carboxamide [French] [ACD/IUPAC Name]
2-(3,5-Dimethyl-phenyl)-3-[2-(4-pyridin-3-yl-butylamino)-ethyl]-1H-indole-5-carboxylic acid cyclohexyl-ethyl-amide
CHEMBL290991
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL290991/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 764.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.3±3.0 kJ/mol
Flash Point: 415.8±32.9 °C
Index of Refraction: 1.623
Molar Refractivity: 169.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 41.88
ACD/KOC (pH 5.5): 56.70
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 183.64
ACD/KOC (pH 7.4): 248.61
Polar Surface Area: 61 Å2
Polarizability: 67.3±0.5 10-24cm3
Surface Tension: 55.8±5.0 dyne/cm
Molar Volume: 481.3±5.0 cm3

Click to predict properties on the Chemicalize site


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