6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran

C32H26O4 — CID 163463358

IUPAC6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran
SMILESCOc1ccc2c(C)c(-c3ccccc3)oc2c1-c1c(OC)ccc2c(C)c(-c3ccccc3)oc12
InChIInChI=1S/C32H26O4/c1-19-23-15-17-25(33-3)27(31(23)35-29(19)21-11-7-5-8-12-21)28-26(34-4)18-16-24-20(2)30(36-32(24)28)22-13-9-6-10-14-22/h5-18H,1-4H3
InChIKeyBQMSLYXBORSHRP-UHFFFAOYSA-N
MW474.56 g/mol
LogP8.81
Rot. Bonds5

About 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran

6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran (PubChem CID 163463358) has the molecular formula C32H26O4 and a molecular weight of 474.56 g/mol. Its IUPAC name is 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran.

Molecular Properties

Compound Name6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran
PubChem CID163463358
Molecular FormulaC32H26O4
Molecular Weight474.56 g/mol
Exact Mass474.18
IUPAC Name6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran
SMILESCOc1ccc2c(C)c(-c3ccccc3)oc2c1-c1c(OC)ccc2c(C)c(-c3ccccc3)oc12
InChIInChI=1S/C32H26O4/c1-19-23-15-17-25(33-3)27(31(23)35-29(19)21-11-7-5-8-12-21)28-26(34-4)18-16-24-20(2)30(36-32(24)28)22-13-9-6-10-14-22/h5-18H,1-4H3
InChIKeyBQMSLYXBORSHRP-UHFFFAOYSA-N
XLogP8.81
TPSA44.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.56
LogP ≤ 58.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran?
The IUPAC name of 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran (CID 163463358) is 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran.
What is the SMILES notation for 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran?
The canonical SMILES for 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran is COc1ccc2c(C)c(-c3ccccc3)oc2c1-c1c(OC)ccc2c(C)c(-c3ccccc3)oc12.
What is the InChIKey of 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran?
The InChIKey is BQMSLYXBORSHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26O4/c1-19-23-15-17-25(33-3)27(31(23)35-29(19)21-11-7-5-8-12-21)28-26(34-4)18-16-24-20(2)30(36-32(24)28)22-13-9-6-10-14-22/h5-18H,1-4H3.
What are the key properties of 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran?
6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran has a molecular weight of 474.56 g/mol, XLogP of 8.81, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-7-(6-methoxy-3-methyl-2-phenyl-1-benzofuran-7-yl)-3-methyl-2-phenyl-1-benzofuran is sourced from PubChem (CID 163463358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).