Found 35 results

Search term: C39H38N4O8 (Found by molecular formula)
ChemSpider 2D Image | 4-[3-{[2-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethyl]amino}-2-({[1,3-dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-3-oxopropyl]phenyl acetate | C39H38N4O8

4-[3-{[2-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethyl]amino}-2-({[1,3-dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-3-oxopropyl]phenyl acetate

  • Molecular FormulaC39H38N4O8
  • Average mass690.741 Da
  • Monoisotopic mass690.268982 Da
  • ChemSpider ID121019921

More details:

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

1H-Isoindole-5-carboxamide, N-[1-[[4-(acetyloxy)phenyl]methyl]-2-[[2-(1,3-benzodioxol-5-yl)-2-(dimethylamino)ethyl]amino]-2-oxoethyl]-2,3-dihydro-1,3-dioxo-2-(2-phenylethyl)- [ACD/Index Name]
4-[3-{[2-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethyl]amino}-2-({[1,3-dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-3-oxopropyl]phenyl acetate [ACD/IUPAC Name]
4-[3-{[2-(1,3-Benzodioxol-5-yl)-2-(dimethylamino)ethyl]amino}-2-({[1,3-dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-3-oxopropyl]phenyl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-[3-{[2-(1,3-benzodioxol-5-yl)-2-(diméthylamino)éthyl]amino}-2-({[1,3-dioxo-2-(2-phényléthyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}amino)-3-oxopropyl]phényle [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: 897.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.5±3.0 kJ/mol
Flash Point: 496.5±34.3 °C
Index of Refraction: 1.630
Molar Refractivity: 186.7±0.3 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 8.70
ACD/KOC (pH 5.5): 46.21
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 348.36
ACD/KOC (pH 7.4): 1849.58
Polar Surface Area: 144 Å2
Polarizability: 74.0±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 524.8±3.0 cm3

Click to predict properties on the Chemicalize site


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