ZRK

2-(4-PYRIDINYL)FURO[3,2-C]PYRIDIN-4(5H)-ONE

Created: 2011-06-16
Last modified:  2014-05-01

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count26
Aromatic Bond Count11
2D diagram of ZRK

Chemical Component Summary

Name2-(4-PYRIDINYL)FURO[3,2-C]PYRIDIN-4(5H)-ONE
Systematic Name (OpenEye OEToolkits)2-pyridin-4-yl-5H-furo[3,2-c]pyridin-4-one
FormulaC12 H8 N2 O2
Molecular Weight212.204
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=C2NC=Cc1oc(cc12)c3ccncc3
SMILESCACTVS3.370O=C1NC=Cc2oc(cc12)c3ccncc3
SMILESOpenEye OEToolkits1.7.2c1cnccc1c2cc3c(o2)C=CNC3=O
Canonical SMILESCACTVS3.370 O=C1NC=Cc2oc(cc12)c3ccncc3
Canonical SMILESOpenEye OEToolkits1.7.2 c1cnccc1c2cc3c(o2)C=CNC3=O
InChIInChI1.03 InChI=1S/C12H8N2O2/c15-12-9-7-11(8-1-4-13-5-2-8)16-10(9)3-6-14-12/h1-7H,(H,14,15)
InChIKeyInChI1.03 NLYCKXUGHPVKMO-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 53245729
ChEMBL CHEMBL1738951