Found 10 results

Search term: MF = 'C_{38}H_{36}F_{2}N_{4}O_{4}'
ChemSpider 2D Image | Nalpha-{[1,3-Dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}-4-fluoro-N-[2-(4-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]phenylalaninamide | C38H36F2N4O4

Nα-{[1,3-Dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}-4-fluoro-N-[2-(4-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]phenylalaninamide

  • Molecular FormulaC38H36F2N4O4
  • Average mass650.714 Da
  • Monoisotopic mass650.270447 Da
  • ChemSpider ID121054067

More details:

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

1H-Isoindole-5-carboxamide, N-[1-[(4-fluorophenyl)methyl]-2-[[2-(4-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]amino]-2-oxoethyl]-2,3-dihydro-1,3-dioxo-2-(2-phenylethyl)- [ACD/Index Name]
Nα-{[1,3-Dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}-4-fluor-N-[2-(4-fluorphenyl)-2-(1-pyrrolidinyl)ethyl]phenylalaninamid [German] [ACD/IUPAC Name]
Nα-{[1,3-Dioxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}-4-fluoro-N-[2-(4-fluorophenyl)-2-(1-pyrrolidinyl)ethyl]phenylalaninamide [ACD/IUPAC Name]
Nα-{[1,3-Dioxo-2-(2-phényléthyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}-4-fluoro-N-[2-(4-fluorophényl)-2-(1-pyrrolidinyl)éthyl]phénylalaninamide [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: 854.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 124.1±3.0 kJ/mol
Flash Point: 470.5±34.3 °C
Index of Refraction: 1.628
Molar Refractivity: 176.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.82
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 10.87
ACD/KOC (pH 5.5): 35.06
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 524.18
ACD/KOC (pH 7.4): 1690.16
Polar Surface Area: 99 Å2
Polarizability: 69.8±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 496.4±3.0 cm3

Click to predict properties on the Chemicalize site


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