Chemical Component Summary

Name6-azanyl-2-(2-methoxyethoxy)-9-(phenylmethyl)-7H-purin-8-one
Identifiers6-azanyl-2-(2-methoxyethoxy)-9-(phenylmethyl)-7~{H}-purin-8-one
FormulaC15 H17 N5 O3
Molecular Weight315.327
TypeNON-POLYMER
Isomeric SMILESCOCCOc1nc(c2c(n1)N(C(=O)N2)Cc3ccccc3)N
InChIInChI=1S/C15H17N5O3/c1-22-7-8-23-14-18-12(16)11-13(19-14)20(15(21)17-11)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,17,21)(H2,16,18,19)
InChIKeyYYCDGEZXHXHLGW-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count0
Bond Count42
Aromatic Bond Count12

Related Resource References

Resource NameReference
Pharos CHEMBL210884
PubChem 10018576
ChEMBL CHEMBL210884
CCDC/CSD UFEHEV