JG8

BENZOFURO[3,2-D]PYRIMIDIN-4(3H)-ONE

Created:	2015-09-22
Last modified:	2016-10-05

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2 entries where JG8 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	20
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	10

2D diagram of JG8

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Chemical Component Summary
Name	BENZOFURO[3,2-D]PYRIMIDIN-4(3H)-ONE
Systematic Name (OpenEye OEToolkits)	3H-[1]benzofuro[3,2-d]pyrimidin-4-one
Formula	C₁₀ H₆ N₂ O₂
Molecular Weight	186.167
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=C1NC=Nc2c1oc3ccccc23
SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)c3c(o2)C(=O)NC=N3
Canonical SMILES	CACTVS	3.385	O=C1NC=Nc2c1oc3ccccc23
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)c3c(o2)C(=O)NC=N3
InChI	InChI	1.03	InChI=1S/C10H6N2O2/c13-10-9-8(11-5-12-10)6-3-1-2-4-7(6)14-9/h1-5H,(H,11,12,13)
InChIKey	InChI	1.03	PCCWPSFTRGJXEF-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	604136, 5291411, 135415469
ChEMBL	CHEMBL1491070

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