6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine

C25H14FNOS — CID 155628936

IUPAC6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine
SMILESFc1ccc(-c2cc3ccc(-c4cccc5c4oc4ccccc45)nc3s2)cc1
InChIInChI=1S/C25H14FNOS/c26-17-11-8-15(9-12-17)23-14-16-10-13-21(27-25(16)29-23)20-6-3-5-19-18-4-1-2-7-22(18)28-24(19)20/h1-14H
InChIKeyDQWVZOVJCIVWDM-UHFFFAOYSA-N
MW395.46 g/mol
LogP7.67
Rot. Bonds2

About 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine

6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine (PubChem CID 155628936) has the molecular formula C25H14FNOS and a molecular weight of 395.46 g/mol. Its IUPAC name is 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine.

Molecular Properties

Compound Name6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine
PubChem CID155628936
Molecular FormulaC25H14FNOS
Molecular Weight395.46 g/mol
Exact Mass395.08
IUPAC Name6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine
SMILESFc1ccc(-c2cc3ccc(-c4cccc5c4oc4ccccc45)nc3s2)cc1
InChIInChI=1S/C25H14FNOS/c26-17-11-8-15(9-12-17)23-14-16-10-13-21(27-25(16)29-23)20-6-3-5-19-18-4-1-2-7-22(18)28-24(19)20/h1-14H
InChIKeyDQWVZOVJCIVWDM-UHFFFAOYSA-N
XLogP7.67
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.46
LogP ≤ 57.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-Amino-4-(furan-2-yl)-6-phenylthieno[2,3-b]pyridin-2-yl)(4-fluorophenyl)methanone
CID 1415611
3-Amino-4-(benzofuran-2-yl)-6-methylthieno[2,3-b]pyridine-2-carboxamide
CID 45485795
2-(3-Methyl-1-benzofuran-2-yl)-1,3-benzothiazole
CID 8829250
2-(Dibenzo[b,d]furan-2-yl)benzo[d]thiazole
CID 2324946
2-[4-[2-(2-Ethyl-1-benzofuran-3-yl)-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-5-methylthiophen-2-yl]pyridine
CID 102583652
(2E)-2-benzothiazol-2-yl-3-[5-(4-fluorophenyl)(2-furyl)]prop-2-enenitrile
CID 5943023
3-methyl-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1,3-benzothiazol-3-ium iodide
CID 45043069
3-methyl-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1,3-benzothiazol-3-ium
CID 5854462
3-ethyl-2-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1,3-benzothiazol-3-ium
CID 5930663
6-[(E)-2-(5-fluoro-1,3-benzothiazol-2-yl)ethenyl]-2,3-dihydrochromen-4-one
CID 19019505
6-[1-(5-Fluoro-1,3-benzothiazol-2-yl)ethenyl]-2,3-dihydrochromen-4-one
CID 19019514
6-[2-(5-Fluoro-1,3-benzothiazol-2-yl)ethenyl]-2,3-dihydrochromen-4-one
CID 54165711

Frequently Asked Questions

What is the IUPAC name of 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine?
The IUPAC name of 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine (CID 155628936) is 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine.
What is the SMILES notation for 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine?
The canonical SMILES for 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine is Fc1ccc(-c2cc3ccc(-c4cccc5c4oc4ccccc45)nc3s2)cc1.
What is the InChIKey of 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine?
The InChIKey is DQWVZOVJCIVWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H14FNOS/c26-17-11-8-15(9-12-17)23-14-16-10-13-21(27-25(16)29-23)20-6-3-5-19-18-4-1-2-7-22(18)28-24(19)20/h1-14H.
What are the key properties of 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine?
6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine has a molecular weight of 395.46 g/mol, XLogP of 7.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-dibenzofuran-4-yl-2-(4-fluorophenyl)thieno[2,3-b]pyridine is sourced from PubChem (CID 155628936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).