There will be scheduled maintenance work beginning on Wednesday 26th February 2020 from 11:00 AM through to 12.00 PM (GMT).

During this time, you may not be able to log into ChemSpider. We apologise for any inconvenience this might cause and thank you for your patience.

ChemSpider 2D Image | Methyl N-{[1-(4-fluorobenzyl)-1H-indol-3-yl]carbonyl}-L-valinate | C22H23FN2O3

Methyl N-{[1-(4-fluorobenzyl)-1H-indol-3-yl]carbonyl}-L-valinate

  • Molecular FormulaC22H23FN2O3
  • Average mass382.428 Da
  • Monoisotopic mass382.169281 Da
  • ChemSpider ID57621605
  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Valine, N-[[1-[(4-fluorophenyl)methyl]-1H-indol-3-yl]carbonyl]-, methyl ester [ACD/Index Name]
Methyl N-{[1-(4-fluorobenzyl)-1H-indol-3-yl]carbonyl}-L-valinate [ACD/IUPAC Name]
Methyl-N-{[1-(4-fluorbenzyl)-1H-indol-3-yl]carbonyl}-L-valinat [German] [ACD/IUPAC Name]
N-{[1-(4-Fluorobenzyl)-1H-indol-3-yl]carbonyl}-L-valinate de méthyle [French] [ACD/IUPAC Name]
?N-[[1-[(4-fluorophenyl)methyl]-1H-indol-3-yl]carbonyl]-L-valine, methyl ester?
1971007-90-5 [RN]
​N-[[1-[(4-fluorophenyl)methyl]-1H-indol-3-yl]carbonyl]-L-valine, methyl ester​

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 599.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 316.0±28.7 °C
Index of Refraction: 1.579
Molar Refractivity: 105.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 4.13
ACD/BCF (pH 5.5): 803.06
ACD/KOC (pH 5.5): 4176.57
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 803.06
ACD/KOC (pH 7.4): 4176.56
Polar Surface Area: 60 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 317.9±7.0 cm3

Click to predict properties on the Chemicalize site