rg2

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 21
Total Number of Articles : 6
PubChem 86287491
Molecular Formula

C17H11ClF3N3O2

SMILES

C1=CC(=CC=C1CNC2=NC3=C(C=CC(=C3)C(F)(F)F)N=C2C(=O)O)Cl

InChI

InChI=1S/C17H11ClF3N3O2/c18-11-4-1-9(2-5-11)8-22-15-14(16(25)26)23-12-6-3-10(17(19,20)21)7-13(12)24-15/h1-7H,8H2,(H,22,24)(H,25,26)

synonyms
  • CHEMBL4591732
  • 3-[(4-Chlorobenzyl)amino]-6-(Trifluoromethyl)quinoxaline-2-Carboxylic Acid
  • QN124
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Properties
Property Value
MW 381.7 g/mol
HBD 2
HBA 8
Rotatable Bond Count 4
Exact Mass 381.0491888 g/mol
Monoisotopic Mass 381.0491888 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 500
xlogp 4.9
Topological Polar Surface Area 75.1