4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole

C14H8N2O2Te — CID 138376979

IUPAC4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole
SMILESc1coc(-c2ccc(-c3ccco3)c3n[te]nc23)c1
InChIInChI=1S/C14H8N2O2Te/c1-3-11(17-7-1)9-5-6-10(12-4-2-8-18-12)14-13(9)15-19-16-14/h1-8H
InChIKeyWNMVCRCFXHAUCA-UHFFFAOYSA-N
MW363.83 g/mol
LogP3.21
Rot. Bonds2

About 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole

4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole (PubChem CID 138376979) has the molecular formula C14H8N2O2Te and a molecular weight of 363.83 g/mol. Its IUPAC name is 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole.

Molecular Properties

Compound Name4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole
PubChem CID138376979
Molecular FormulaC14H8N2O2Te
Molecular Weight363.83 g/mol
Exact Mass365.96
IUPAC Name4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole
SMILESc1coc(-c2ccc(-c3ccco3)c3n[te]nc23)c1
InChIInChI=1S/C14H8N2O2Te/c1-3-11(17-7-1)9-5-6-10(12-4-2-8-18-12)14-13(9)15-19-16-14/h1-8H
InChIKeyWNMVCRCFXHAUCA-UHFFFAOYSA-N
XLogP3.21
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.83
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4,7-Di(furan-2-yl)benzo(c)(1,2,5)thiadiazole
CID 71261032
4,7-Bis[5-(4-fluorophenyl)furan-2-yl]-2,1,3-benzothiadiazole
CID 170274866
4,7-Bis[5-(3,5-difluorophenyl)furan-2-yl]-2,1,3-benzothiadiazole
CID 170274884
4,7-Di(furan-2-yl)benzo[c][1,2,5]oxadiazole
CID 102308075
Benzotriazolylmethylfuran
CID 129781672
4,7-Bis(furan-2-yl)-2-hexylbenzotriazole
CID 139260616
5-[7-(Furan-2-yl)-2-hexylbenzotriazol-4-yl]furan-2-carbaldehyde
CID 139260620
5-[7-(5-Bromofuran-2-yl)-2-hexylbenzotriazol-4-yl]furan-2-carbaldehyde
CID 139260625
4,7-Di(furan-2-yl) benzothiadiazole
CID 166637399
4-(1-Benzofuran-3-yl)-2,1,3-benzothiadiazole
CID 20069378
4,7-Bis(5-bromofuran-2-yl)-2,1,3-benzothiadiazole
CID 22951924
4,7-Bis(3,4,5-trimethylfuran-2-yl)-2,1,3-benzothiadiazole
CID 57578417

Frequently Asked Questions

What is the IUPAC name of 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole?
The IUPAC name of 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole (CID 138376979) is 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole.
What is the SMILES notation for 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole?
The canonical SMILES for 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole is c1coc(-c2ccc(-c3ccco3)c3n[te]nc23)c1.
What is the InChIKey of 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole?
The InChIKey is WNMVCRCFXHAUCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2O2Te/c1-3-11(17-7-1)9-5-6-10(12-4-2-8-18-12)14-13(9)15-19-16-14/h1-8H.
What are the key properties of 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole?
4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole has a molecular weight of 363.83 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-bis(furan-2-yl)-2,1,3-benzotelluradiazole is sourced from PubChem (CID 138376979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).