ChemSpider 2D Image | (3S)-3-Allyl-3-{[(1R)-2-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-1-phenylethyl]amino}-1-(4-methoxybenzyl)-1,3-dihydro-2H-indol-2-one | C33H42N2O3Si

(3S)-3-Allyl-3-{[(1R)-2-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-1-phenylethyl]amino}-1-(4-methoxybenzyl)-1,3-dihydro-2H-indol-2-one

  • Molecular FormulaC33H42N2O3Si
  • Average mass542.784 Da
  • Monoisotopic mass542.296448 Da
  • ChemSpider ID30658967

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S)-3-Allyl-3-{[(1R)-2-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-1-phenylethyl]amino}-1-(4-methoxybenzyl)-1,3-dihydro-2H-indol-2-on [German] [ACD/IUPAC Name]
(3S)-3-Allyl-3-{[(1R)-2-{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-1-phenylethyl]amino}-1-(4-methoxybenzyl)-1,3-dihydro-2H-indol-2-one [ACD/IUPAC Name]
(3S)-3-Allyl-3-{[(1R)-2-{[diméthyl(2-méthyl-2-propanyl)silyl]oxy}-1-phényléthyl]amino}-1-(4-méthoxybenzyl)-1,3-dihydro-2H-indol-2-one [French] [ACD/IUPAC Name]
2H-Indol-2-one, 3-[[(1R)-2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-phenylethyl]amino]-1,3-dihydro-1-[(4-methoxyphenyl)methyl]-3-(2-propen-1-yl)-, (3S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 661.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 353.7±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 163.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.74
ACD/LogD (pH 5.5): 7.07
ACD/BCF (pH 5.5): 137514.22
ACD/KOC (pH 5.5): 162439.08
ACD/LogD (pH 7.4): 7.10
ACD/BCF (pH 7.4): 147676.06
ACD/KOC (pH 7.4): 174442.77
Polar Surface Area: 51 Å2
Polarizability: 64.7±0.5 10-24cm3
Surface Tension: 44.4±5.0 dyne/cm
Molar Volume: 488.0±5.0 cm3

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