ChemSpider 2D Image | Nalpha-(tert-Butoxycarbonyl)-N-[1-(3,4-dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl]-N-(2-furylmethyl)tryptophanamide | C36H46N4O7

Nα-(tert-Butoxycarbonyl)-N-[1-(3,4-dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl]-N-(2-furylmethyl)tryptophanamide

  • Molecular FormulaC36H46N4O7
  • Average mass646.773 Da
  • Monoisotopic mass646.336670 Da
  • ChemSpider ID21106068

More details:

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

Carbamic acid, N-[2-[[1-(3,4-dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl](2-furanylmethyl)amino]-1-(1H-indol-3-ylmethyl)-2-oxoethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-[1-(3,4-Dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl]-N-(2-furylmethyl)-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanamid [German] [ACD/IUPAC Name]
N-[1-(3,4-Dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl]-N-(2-furylmethyl)-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanamide [ACD/IUPAC Name]
N-[1-(3,4-Diméthoxyphényl)-2-oxo-2-(pentylamino)éthyl]-N-(2-furylméthyl)-Nα-{[(2-méthyl-2-propanyl)oxy]carbonyl}tryptophaneamide [French] [ACD/IUPAC Name]
Nα-(tert-Butoxycarbonyl)-N-[1-(3,4-dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl]-N-(2-furylmethyl)tryptophanamide
tert-butyl [1-{[1-(3,4-dimethoxyphenyl)-2-oxo-2-(pentylamino)ethyl](furan-2-ylmethyl)amino}-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 858.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.7±3.0 kJ/mol
Flash Point: 472.8±34.3 °C
Index of Refraction: 1.580
Molar Refractivity: 180.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 3
ACD/LogP: 6.61
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15983.47
ACD/KOC (pH 5.5): 35528.33
ACD/LogD (pH 7.4): 5.83
ACD/BCF (pH 7.4): 15979.19
ACD/KOC (pH 7.4): 35518.81
Polar Surface Area: 135 Å2
Polarizability: 71.5±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 541.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement