ChemSpider 2D Image | 7-[4-({2-[2-(2-Aminoethoxy)ethoxy]ethyl}carbamoyl)-2-methylphenyl]-3-[3-(1-naphthyloxy)propyl]-1H-indole-2-carboxylic acid | C36H39N3O6

7-[4-({2-[2-(2-Aminoethoxy)ethoxy]ethyl}carbamoyl)-2-methylphenyl]-3-[3-(1-naphthyloxy)propyl]-1H-indole-2-carboxylic acid

  • Molecular FormulaC36H39N3O6
  • Average mass609.711 Da
  • Monoisotopic mass609.283875 Da
  • ChemSpider ID24808504

More details:

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

1H-Indole-2-carboxylic acid, 7-[4-[[[2-[2-(2-aminoethoxy)ethoxy]ethyl]amino]carbonyl]-2-methylphenyl]-3-[3-(1-naphthalenyloxy)propyl]- [ACD/Index Name]
7-[4-({2-[2-(2-Aminoethoxy)ethoxy]ethyl}carbamoyl)-2-methylphenyl]-3-[3-(1-naphthyloxy)propyl]-1H-indol-2-carbonsäure [German] [ACD/IUPAC Name]
7-[4-({2-[2-(2-Aminoethoxy)ethoxy]ethyl}carbamoyl)-2-methylphenyl]-3-[3-(1-naphthyloxy)propyl]-1H-indole-2-carboxylic acid [ACD/IUPAC Name]
Acide 7-[4-({2-[2-(2-aminoéthoxy)éthoxy]éthyl}carbamoyl)-2-méthylphényl]-3-[3-(1-naphtyloxy)propyl]-1H-indole-2-carboxylique [French] [ACD/IUPAC Name]
Kinome_2989

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

Density: 1.3±0.1 g/cm3
Boiling Point: 853.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.0±3.0 kJ/mol
Flash Point: 470.1±34.3 °C
Index of Refraction: 1.647
Molar Refractivity: 177.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 51.58
ACD/KOC (pH 5.5): 112.71
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 52.51
ACD/KOC (pH 7.4): 114.74
Polar Surface Area: 136 Å2
Polarizability: 70.2±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 487.1±3.0 cm3

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