Found 1 result

Search term: KDRGWBDOBCLUSE-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-{2-[7-{[4-Chloro-3-(trifluoromethyl)benzyl]amino}-3-(4-methoxyphenyl)-2-oxo-1(2H)-quinoxalinyl]ethyl}acetamide | C27H24ClF3N4O3

N-{2-[7-{[4-Chloro-3-(trifluoromethyl)benzyl]amino}-3-(4-methoxyphenyl)-2-oxo-1(2H)-quinoxalinyl]ethyl}acetamide

  • Molecular FormulaC27H24ClF3N4O3
  • Average mass544.953 Da
  • Monoisotopic mass544.148926 Da
  • ChemSpider ID24705987

More details:

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

Acetamide, N-[2-[7-[[[4-chloro-3-(trifluoromethyl)phenyl]methyl]amino]-3-(4-methoxyphenyl)-2-oxo-1(2H)-quinoxalinyl]ethyl]- [ACD/Index Name]
N-{2-[7-{[4-Chlor-3-(trifluormethyl)benzyl]amino}-3-(4-methoxyphenyl)-2-oxo-1(2H)-chinoxalinyl]ethyl}acetamid [German] [ACD/IUPAC Name]
N-{2-[7-{[4-Chloro-3-(trifluoromethyl)benzyl]amino}-3-(4-methoxyphenyl)-2-oxo-1(2H)-quinoxalinyl]ethyl}acetamide [ACD/IUPAC Name]
N-{2-[7-{[4-Chloro-3-(trifluorométhyl)benzyl]amino}-3-(4-méthoxyphényl)-2-oxo-1(2H)-quinoxalinyl]éthyl}acétamide [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL494748/

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.603
Molar Refractivity: 137.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 3533.85
ACD/KOC (pH 5.5): 12061.83
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 3534.33
ACD/KOC (pH 7.4): 12063.47
Polar Surface Area: 83 Å2
Polarizability: 54.5±0.5 10-24cm3
Surface Tension: 44.0±7.0 dyne/cm
Molar Volume: 400.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement