Chemical Component Summary

Name6-chloro-9-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-9H-purin-2-amine
SynonymsBIIB021
Identifiers6-chloro-9-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]purin-2-amine
FormulaC14 H15 Cl N6 O
Molecular Weight318.762
TypeNON-POLYMER
Isomeric SMILESCc1cnc(c(c1OC)C)Cn2cnc3c2nc(nc3Cl)N
InChIInChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20)
InChIKeyQULDDKSCVCJTPV-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count37
Chiral Atom Count0
Bond Count39
Aromatic Bond Count16

Drug Info: DrugBank

DrugBank IDDB12359 
NameBIIB021
Groups investigational
DescriptionBIIB021 has been investigated for the treatment of Tumors and Lymphoma.
Synonyms
  • Biib021 Mesylate
  • BIIB021
Categories
  • Heterocyclic Compounds, Fused-Ring
  • HSP90 Heat-Shock Proteins, antagonists & inhibitors
  • Purines
CAS number848695-25-0

Related Resource References

Resource NameReference
Pharos CHEMBL467399
PubChem 16736529
ChEMBL CHEMBL467399
ChEBI CHEBI:90687
CCDC/CSD QOCCIX