Chemical Component Summary

Name4-[[6-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]methyl]phenol
Identifiers4-[[6-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]methyl]phenol
FormulaC17 H12 F N5 O
Molecular Weight321.308
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1Cc2nnc3n2nc(cn3)c4ccc(cc4)F)O
InChIInChI=1S/C17H12FN5O/c18-13-5-3-12(4-6-13)15-10-19-17-21-20-16(23(17)22-15)9-11-1-7-14(24)8-2-11/h1-8,10,24H,9H2
InChIKeyNBRHZLRAQNRJSZ-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count36
Chiral Atom Count0
Bond Count39
Aromatic Bond Count22

Related Resource References

Resource NameReference
Pharos CHEMBL2170957
PubChem 11324689
ChEMBL CHEMBL2170957