Chemical Component Summary

Name6-azanyl-2-(2-methoxyethoxy)-9-(pyridin-3-ylmethyl)-7H-purin-8-one
Identifiers6-azanyl-2-(2-methoxyethoxy)-9-(pyridin-3-ylmethyl)-7~{H}-purin-8-one
FormulaC14 H16 N6 O3
Molecular Weight316.315
TypeNON-POLYMER
Isomeric SMILESCOCCOc1nc(c2c(n1)N(C(=O)N2)Cc3cccnc3)N
InChIInChI=1S/C14H16N6O3/c1-22-5-6-23-13-18-11(15)10-12(19-13)20(14(21)17-10)8-9-3-2-4-16-7-9/h2-4,7H,5-6,8H2,1H3,(H,17,21)(H2,15,18,19)
InChIKeyXWTNEKDECZWUJX-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count39
Chiral Atom Count0
Bond Count41
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 22928870