3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene

C17H14O4 — CID 624785

IUPAC3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene
SMILESCOc1ccc2c(c1)OCc1c-2oc2cc(OC)ccc12
InChIInChI=1S/C17H14O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8H,9H2,1-2H3
InChIKeyFLEXCYTURSFUNC-UHFFFAOYSA-N
MW282.30 g/mol
LogP4.01
Rot. Bonds2

About 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene

3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene (PubChem CID 624785) has the molecular formula C17H14O4 and a molecular weight of 282.30 g/mol. Its IUPAC name is 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene.

Molecular Properties

Compound Name3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene
PubChem CID624785
Molecular FormulaC17H14O4
Molecular Weight282.30 g/mol
Exact Mass282.09
IUPAC Name3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene
SMILESCOc1ccc2c(c1)OCc1c-2oc2cc(OC)ccc12
InChIInChI=1S/C17H14O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8H,9H2,1-2H3
InChIKeyFLEXCYTURSFUNC-UHFFFAOYSA-N
XLogP4.01
TPSA40.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene?
The IUPAC name of 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene (CID 624785) is 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene.
What is the SMILES notation for 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene?
The canonical SMILES for 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene is COc1ccc2c(c1)OCc1c-2oc2cc(OC)ccc12.
What is the InChIKey of 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene?
The InChIKey is FLEXCYTURSFUNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8H,9H2,1-2H3.
What are the key properties of 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene?
3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene has a molecular weight of 282.30 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene is sourced from PubChem (CID 624785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).