3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran

C23H20O4 — CID 71608239

IUPAC3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran
SMILESCOc1ccc(-c2oc3ccccc3c2-c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C23H20O4/c1-24-17-10-8-15(9-11-17)23-22(20-6-4-5-7-21(20)27-23)16-12-18(25-2)14-19(13-16)26-3/h4-14H,1-3H3
InChIKeyAUPMKIKZBNJYCM-UHFFFAOYSA-N
MW360.41 g/mol
LogP5.79
Rot. Bonds5

About 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran

3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran (PubChem CID 71608239) has the molecular formula C23H20O4 and a molecular weight of 360.41 g/mol. Its IUPAC name is 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran.

Molecular Properties

Compound Name3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran
PubChem CID71608239
Molecular FormulaC23H20O4
Molecular Weight360.41 g/mol
Exact Mass360.14
IUPAC Name3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran
SMILESCOc1ccc(-c2oc3ccccc3c2-c2cc(OC)cc(OC)c2)cc1
InChIInChI=1S/C23H20O4/c1-24-17-10-8-15(9-11-17)23-22(20-6-4-5-7-21(20)27-23)16-12-18(25-2)14-19(13-16)26-3/h4-14H,1-3H3
InChIKeyAUPMKIKZBNJYCM-UHFFFAOYSA-N
XLogP5.79
TPSA40.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.41
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-5-methyl-1-benzofuran
CID 141261100
3-(3-methoxyphenyl)-2-(4-methylphenyl)-1-benzofuran
CID 135057387
2-(4-methoxyphenyl)-1-benzofuran-3-amine
CID 102535586
2-(4-methoxyphenyl)-1-benzofuran-3-carbaldehyde
CID 12550686
4-[2-(4-methoxyphenyl)-3,5-diphenylfuro[3,2-f][1]benzofuran-6-yl]benzonitrile
CID 10391863
9,10-bis(3,5-dimethoxyphenyl)anthracene
CID 11961931
2-(4-methoxyphenyl)-4-sulfanylidenechromene-3-carbonitrile
CID 134911345
2-(3,5-dimethoxyphenyl)-3-hydroxychromen-4-one
CID 66573994
3-(4-methoxyphenyl)-4-(4-methylphenyl)isochromen-1-one
CID 122367134
2,3-bis(4-fluorophenyl)-1-benzofuran
CID 71732324
4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol
CID 139612412
4-[2,3-bis(4-methoxyphenyl)-1-benzofuran-5-yl]morpholine
CID 25011565

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran?
The IUPAC name of 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran (CID 71608239) is 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran.
What is the SMILES notation for 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran?
The canonical SMILES for 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran is COc1ccc(-c2oc3ccccc3c2-c2cc(OC)cc(OC)c2)cc1.
What is the InChIKey of 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran?
The InChIKey is AUPMKIKZBNJYCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O4/c1-24-17-10-8-15(9-11-17)23-22(20-6-4-5-7-21(20)27-23)16-12-18(25-2)14-19(13-16)26-3/h4-14H,1-3H3.
What are the key properties of 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran?
3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran has a molecular weight of 360.41 g/mol, XLogP of 5.79, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran is sourced from PubChem (CID 71608239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).