2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran

C22H18OTe — CID 177419881

IUPAC2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran
SMILESCc1ccc([Te]c2c(-c3ccc(C)cc3)oc3ccccc23)cc1
InChIInChI=1S/C22H18OTe/c1-15-7-11-17(12-8-15)21-22(19-5-3-4-6-20(19)23-21)24-18-13-9-16(2)10-14-18/h3-14H,1-2H3
InChIKeyMXDHDBQIFMBFNU-UHFFFAOYSA-N
MW425.99 g/mol
LogP4.37
Rot. Bonds3

About 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran

2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran (PubChem CID 177419881) has the molecular formula C22H18OTe and a molecular weight of 425.99 g/mol. Its IUPAC name is 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran.

Molecular Properties

Compound Name2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran
PubChem CID177419881
Molecular FormulaC22H18OTe
Molecular Weight425.99 g/mol
Exact Mass428.04
IUPAC Name2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran
SMILESCc1ccc([Te]c2c(-c3ccc(C)cc3)oc3ccccc23)cc1
InChIInChI=1S/C22H18OTe/c1-15-7-11-17(12-8-15)21-22(19-5-3-4-6-20(19)23-21)24-18-13-9-16(2)10-14-18/h3-14H,1-2H3
InChIKeyMXDHDBQIFMBFNU-UHFFFAOYSA-N
XLogP4.37
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.99
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

4-(4-chlorophenyl)tellanyl-N-(4-methylphenyl)-3-phenylisochromen-1-imine
CID 122383888
6,11-bis(4-methylphenyl)indeno[1,2-c]chromene
CID 71490854
3-methoxy-2-(4-methylphenyl)chromen-4-one
CID 139049420
3-[4-[4-(4-methylphenyl)phenyl]phenyl]dibenzofuran
CID 67964733
CID 59413433
CID 59413433
4-[2-(4-methylphenyl)-1-benzofuran-3-yl]-5-phenyl-2H-triazole
CID 138393037
3-(3-methoxyphenyl)-2-(4-methylphenyl)-1-benzofuran
CID 135057387
3-[1-(4-methylphenyl)propa-1,2-dienyl]-2-phenyl-1-benzofuran
CID 15854138
2-(4-hydroxyphenyl)-3-methylchromen-4-one
CID 11579699
5-[4-(4-methylphenyl)phenyl]naphtho[1,2-b][1]benzofuran
CID 118887094
3-(2-methylpropyl)-2-phenyl-1-benzofuran
CID 11572364
3-methyl-2-naphthalen-2-yl-1-benzofuran
CID 54024232

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran?
The IUPAC name of 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran (CID 177419881) is 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran.
What is the SMILES notation for 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran?
The canonical SMILES for 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran is Cc1ccc([Te]c2c(-c3ccc(C)cc3)oc3ccccc23)cc1.
What is the InChIKey of 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran?
The InChIKey is MXDHDBQIFMBFNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18OTe/c1-15-7-11-17(12-8-15)21-22(19-5-3-4-6-20(19)23-21)24-18-13-9-16(2)10-14-18/h3-14H,1-2H3.
What are the key properties of 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran?
2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran has a molecular weight of 425.99 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-3-(4-methylphenyl)tellanyl-1-benzofuran is sourced from PubChem (CID 177419881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).