5MA

1-(2,5-dichloro-3-{[5-chloro-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1H-benzotriazol-4-yl]oxy}phenyl)methanamine


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Chemical Component Summary

Name1-(2,5-dichloro-3-{[5-chloro-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)-1H-benzotriazol-4-yl]oxy}phenyl)methanamine
Identifiers[2,5-bis(chloranyl)-3-[5-chloranyl-1-(2H-pyrazolo[3,4-b]pyridin-3-ylmethyl)benzotriazol-4-yl]oxy-phenyl]methanamine
FormulaC20 H14 Cl3 N7 O
Molecular Weight474.73
TypeNON-POLYMER
Isomeric SMILESc1cc2c([nH]nc2nc1)Cn3c4ccc(c(c4nn3)Oc5cc(cc(c5Cl)CN)Cl)Cl
InChIInChI=1S/C20H14Cl3N7O/c21-11-6-10(8-24)17(23)16(7-11)31-19-13(22)3-4-15-18(19)27-29-30(15)9-14-12-2-1-5-25-20(12)28-26-14/h1-7H,8-9,24H2,(H,25,26,28)
InChIKeyCUYHWBGVPXGMKQ-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count0
Bond Count49
Aromatic Bond Count26

Related Resource References

Resource NameReference
PubChem 53393817
ChEMBL CHEMBL1939501