6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran

C23H20O4 — CID 57332865

IUPAC6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran
SMILESCOc1ccc2cc(-c3ccc(OCc4ccccc4)c(OC)c3)oc2c1
InChIInChI=1S/C23H20O4/c1-24-19-10-8-17-12-21(27-22(17)14-19)18-9-11-20(23(13-18)25-2)26-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3
InChIKeySUCUXANJNADIEL-UHFFFAOYSA-N
MW360.41 g/mol
LogP5.70
Rot. Bonds6

About 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran

6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran (PubChem CID 57332865) has the molecular formula C23H20O4 and a molecular weight of 360.41 g/mol. Its IUPAC name is 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran.

Molecular Properties

Compound Name6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran
PubChem CID57332865
Molecular FormulaC23H20O4
Molecular Weight360.41 g/mol
Exact Mass360.14
IUPAC Name6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran
SMILESCOc1ccc2cc(-c3ccc(OCc4ccccc4)c(OC)c3)oc2c1
InChIInChI=1S/C23H20O4/c1-24-19-10-8-17-12-21(27-22(17)14-19)18-9-11-20(23(13-18)25-2)26-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3
InChIKeySUCUXANJNADIEL-UHFFFAOYSA-N
XLogP5.70
TPSA40.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.41
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2,4-bis(phenylmethoxy)phenyl]-6-methoxy-1-benzofuran
CID 141293707
2,5-bis(3-methoxy-4-phenylmethoxyphenyl)-3,4-bis(2-methylpropyl)furan
CID 19049290
2-(3-hydroxy-4-methoxyphenyl)-7-phenylmethoxychromen-4-one
CID 139217483
2-(4-methoxyphenyl)-1-benzofuran
CID 10727834
2-(4-methoxyphenyl)-1-benzofuran-6-ol
CID 14887928
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one;5-methyl-2-(4-methyl-3-phenylmethoxyphenyl)-7-phenylmethoxychromen-4-one
CID 86755123
methyl 2-(4-fluorophenyl)-5-(3-methoxy-4-phenylmethoxyphenyl)furan-3-carboxylate
CID 122400276
3,4-bis[3,4-bis(phenylmethoxy)phenyl]-1-[(4-methoxyphenyl)methyl]pyrrole
CID 141383099
2-[4-(4-methoxyphenyl)phenyl]-1-benzofuran
CID 141017099
[2-(3,4-dimethoxyphenyl)-6-methoxychromen-4-ylidene]-(2-phenylethyl)azanium perchlorate
CID 20998969
(3S,4S)-3-(4-methoxyphenyl)-4-(3-methoxy-4-phenylmethoxyphenyl)oxolan-2-one
CID 177415450
2-(chloromethyl)-5-(3-methoxy-4-phenylmethoxyphenyl)-1,3,4-oxadiazole
CID 46944561

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran?
The IUPAC name of 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran (CID 57332865) is 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran.
What is the SMILES notation for 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran?
The canonical SMILES for 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran is COc1ccc2cc(-c3ccc(OCc4ccccc4)c(OC)c3)oc2c1.
What is the InChIKey of 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran?
The InChIKey is SUCUXANJNADIEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O4/c1-24-19-10-8-17-12-21(27-22(17)14-19)18-9-11-20(23(13-18)25-2)26-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3.
What are the key properties of 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran?
6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran has a molecular weight of 360.41 g/mol, XLogP of 5.70, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(3-methoxy-4-phenylmethoxyphenyl)-1-benzofuran is sourced from PubChem (CID 57332865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).