ChemSpider 2D Image | N-(2-{Butyl[(1S)-2-(cyclohexylamino)-1-(2,4-dimethoxyphenyl)-2-oxoethyl]amino}-2-oxoethyl)-2-furamide | C27H37N3O6

N-(2-{Butyl[(1S)-2-(cyclohexylamino)-1-(2,4-dimethoxyphenyl)-2-oxoethyl]amino}-2-oxoethyl)-2-furamide

  • Molecular FormulaC27H37N3O6
  • Average mass499.599 Da
  • Monoisotopic mass499.268250 Da
  • ChemSpider ID62663873

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Furancarboxamide, N-[2-[butyl[(1S)-2-(cyclohexylamino)-1-(2,4-dimethoxyphenyl)-2-oxoethyl]amino]-2-oxoethyl]- [ACD/Index Name]
N-(2-{Butyl[(1S)-2-(cyclohexylamino)-1-(2,4-dimethoxyphenyl)-2-oxoethyl]amino}-2-oxoethyl)-2-furamid [German] [ACD/IUPAC Name]
N-(2-{Butyl[(1S)-2-(cyclohexylamino)-1-(2,4-dimethoxyphenyl)-2-oxoethyl]amino}-2-oxoethyl)-2-furamide [ACD/IUPAC Name]
N-(2-{Butyl[(1S)-2-(cyclohexylamino)-1-(2,4-diméthoxyphényl)-2-oxoéthyl]amino}-2-oxoéthyl)-2-furamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 769.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.0±3.0 kJ/mol
Flash Point: 419.1±32.9 °C
Index of Refraction: 1.568
Molar Refractivity: 135.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 116.00
ACD/KOC (pH 5.5): 1045.56
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 116.00
ACD/KOC (pH 7.4): 1045.56
Polar Surface Area: 110 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 52.5±5.0 dyne/cm
Molar Volume: 414.6±5.0 cm3

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