9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol

C16H12O5 — CID 101092239

IUPAC9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol
SMILESCOc1cc2oc3c(c2cc1O)COc1cc(O)ccc1-3
InChIInChI=1S/C16H12O5/c1-19-15-6-14-10(5-12(15)18)11-7-20-13-4-8(17)2-3-9(13)16(11)21-14/h2-6,17-18H,7H2,1H3
InChIKeyCZJSVJBVSXTTCY-UHFFFAOYSA-N
MW284.27 g/mol
LogP3.41
Rot. Bonds1

About 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol

9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol (PubChem CID 101092239) has the molecular formula C16H12O5 and a molecular weight of 284.27 g/mol. Its IUPAC name is 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol.

Molecular Properties

Compound Name9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol
PubChem CID101092239
Molecular FormulaC16H12O5
Molecular Weight284.27 g/mol
Exact Mass284.07
IUPAC Name9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol
SMILESCOc1cc2oc3c(c2cc1O)COc1cc(O)ccc1-3
InChIInChI=1S/C16H12O5/c1-19-15-6-14-10(5-12(15)18)11-7-20-13-4-8(17)2-3-9(13)16(11)21-14/h2-6,17-18H,7H2,1H3
InChIKeyCZJSVJBVSXTTCY-UHFFFAOYSA-N
XLogP3.41
TPSA72.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol?
The IUPAC name of 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol (CID 101092239) is 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol.
What is the SMILES notation for 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol?
The canonical SMILES for 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol is COc1cc2oc3c(c2cc1O)COc1cc(O)ccc1-3.
What is the InChIKey of 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol?
The InChIKey is CZJSVJBVSXTTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12O5/c1-19-15-6-14-10(5-12(15)18)11-7-20-13-4-8(17)2-3-9(13)16(11)21-14/h2-6,17-18H,7H2,1H3.
What are the key properties of 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol?
9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol has a molecular weight of 284.27 g/mol, XLogP of 3.41, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxy-6H-[1]benzofuro[3,2-c]chromene-3,8-diol is sourced from PubChem (CID 101092239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).