ChemSpider 2D Image | N~2~-(Adamantan-1-ylcarbamoyl)-N-(4-fluorobenzyl)-N-[2-(1H-indol-3-yl)ethyl]-N~2~-(2-methoxyethyl)glycinamide | C33H41FN4O3

N2-(Adamantan-1-ylcarbamoyl)-N-(4-fluorobenzyl)-N-[2-(1H-indol-3-yl)ethyl]-N2-(2-methoxyethyl)glycinamide

  • Molecular FormulaC33H41FN4O3
  • Average mass560.702 Da
  • Monoisotopic mass560.316284 Da
  • ChemSpider ID3604782

More details:

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

Acetamide, N-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[(2-methoxyethyl)[(tricyclo[3.3.1.13,7]dec-1-ylamino)carbonyl]amino]- [ACD/Index Name]
N2-(Adamantan-1-ylcarbamoyl)-N-(4-fluorbenzyl)-N-[2-(1H-indol-3-yl)ethyl]-N2-(2-methoxyethyl)glycinamid [German] [ACD/IUPAC Name]
N2-(Adamantan-1-ylcarbamoyl)-N-(4-fluorobenzyl)-N-[2-(1H-indol-3-yl)ethyl]-N2-(2-methoxyethyl)glycinamide [ACD/IUPAC Name]
N2-(Adamantan-1-ylcarbamoyl)-N-(4-fluorobenzyl)-N-[2-(1H-indol-3-yl)éthyl]-N2-(2-méthoxyéthyl)glycinamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 787.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 430.3±32.9 °C
Index of Refraction: 1.636
Molar Refractivity: 158.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.24
ACD/LogD (pH 5.5): 5.63
ACD/BCF (pH 5.5): 11226.52
ACD/KOC (pH 5.5): 27590.17
ACD/LogD (pH 7.4): 5.63
ACD/BCF (pH 7.4): 11226.41
ACD/KOC (pH 7.4): 27589.90
Polar Surface Area: 78 Å2
Polarizability: 62.7±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 441.5±5.0 cm3

Click to predict properties on the Chemicalize site


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