Chemical Component Summary

Name5-[1-[(1S)-1-(4-fluorophenyl)ethyl]-[1,2,3]triazolo[4,5-c]quinolin-8-yl]-1,3-benzoxazole
Synonyms(S)-5-(1-(1-(4-fluorophenyl)ethyl)-1H-[1,2,3]triazolo[4,5-c]quinolin-8-yl)benzo[d]oxazole
Identifiers5-[1-[(1~{S})-1-(4-fluorophenyl)ethyl]-[1,2,3]triazolo[4,5-c]quinolin-8-yl]-1,3-benzoxazole
FormulaC24 H16 F N5 O
Molecular Weight409.415
TypeNON-POLYMER
Isomeric SMILESC[C@@H](c1ccc(cc1)F)n2c3c4cc(ccc4ncc3nn2)c5ccc6c(c5)nco6
InChIInChI=1S/C24H16FN5O/c1-14(15-2-6-18(25)7-3-15)30-24-19-10-16(4-8-20(19)26-12-22(24)28-29-30)17-5-9-23-21(11-17)27-13-31-23/h2-14H,1H3/t14-/m0/s1
InChIKeyBHKVSOQUPYXVRZ-AWEZNQCLSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count1
Bond Count52
Aromatic Bond Count31

Related Resource References

Resource NameReference
Pharos CHEMBL4083249
PubChem 129318964
ChEMBL CHEMBL4083249