T30

3-[1-(4-fluorophenyl)cyclopropyl]-4-(1-methylethyl)-5-[4-(trifluoromethoxy)phenyl]-4H-1,2,4-triazole


Toggle HydrogenToggle Labels

Chemical Component Summary

Name3-[1-(4-fluorophenyl)cyclopropyl]-4-(1-methylethyl)-5-[4-(trifluoromethoxy)phenyl]-4H-1,2,4-triazole
Identifiers3-[1-(4-fluorophenyl)cyclopropyl]-4-propan-2-yl-5-[4-(trifluoromethoxy)phenyl]-1,2,4-triazole
FormulaC21 H19 F4 N3 O
Molecular Weight405.389
TypeNON-POLYMER
Isomeric SMILESCC(C)n1c(nnc1C2(CC2)c3ccc(cc3)F)c4ccc(cc4)OC(F)(F)F
InChIInChI=1S/C21H19F4N3O/c1-13(2)28-18(14-3-9-17(10-4-14)29-21(23,24)25)26-27-19(28)20(11-12-20)15-5-7-16(22)8-6-15/h3-10,13H,11-12H2,1-2H3
InChIKeyBDLBQEJTZWWSND-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count48
Chiral Atom Count0
Bond Count51
Aromatic Bond Count18

Related Resource References

Resource NameReference
Pharos CHEMBL476142
PubChem 24941247
ChEMBL CHEMBL476142