3RM

5-{4-[2-(4-bromophenoxy)ethyl]piperazin-1-yl}-4H-1,2,4-triazol-3-amine


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Chemical Component Summary

Name5-{4-[2-(4-bromophenoxy)ethyl]piperazin-1-yl}-4H-1,2,4-triazol-3-amine
Identifiers5-[4-[2-(4-bromanylphenoxy)ethyl]piperazin-1-yl]-4H-1,2,4-triazol-3-amine
FormulaC14 H19 Br N6 O
Molecular Weight367.244
TypeNON-POLYMER
Isomeric SMILESc1cc(ccc1OCCN2CCN(CC2)c3[nH]c(nn3)N)Br
InChIInChI=1S/C14H19BrN6O/c15-11-1-3-12(4-2-11)22-10-9-20-5-7-21(8-6-20)14-17-13(16)18-19-14/h1-4H,5-10H2,(H3,16,17,18,19)
InChIKeyGGFPYJPCWQIIKE-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count0
Bond Count43
Aromatic Bond Count11

Related Resource References

Resource NameReference
Pharos CHEMBL1215473
PubChem 13686033
ChEMBL CHEMBL1215473