4-thieno[3,2-b]pyridin-7-ylphenol

C13H9NOS — CID 166688050

IUPAC4-thieno[3,2-b]pyridin-7-ylphenol
SMILESOc1ccc(-c2ccnc3ccsc23)cc1
InChIInChI=1S/C13H9NOS/c15-10-3-1-9(2-4-10)11-5-7-14-12-6-8-16-13(11)12/h1-8,15H
InChIKeyHDARKTZWNJILLT-UHFFFAOYSA-N
MW227.29 g/mol
LogP3.67
Rot. Bonds1

About 4-thieno[3,2-b]pyridin-7-ylphenol

4-thieno[3,2-b]pyridin-7-ylphenol (PubChem CID 166688050) has the molecular formula C13H9NOS and a molecular weight of 227.29 g/mol. Its IUPAC name is 4-thieno[3,2-b]pyridin-7-ylphenol.

Molecular Properties

Compound Name4-thieno[3,2-b]pyridin-7-ylphenol
PubChem CID166688050
Molecular FormulaC13H9NOS
Molecular Weight227.29 g/mol
Exact Mass227.04
IUPAC Name4-thieno[3,2-b]pyridin-7-ylphenol
SMILESOc1ccc(-c2ccnc3ccsc23)cc1
InChIInChI=1S/C13H9NOS/c15-10-3-1-9(2-4-10)11-5-7-14-12-6-8-16-13(11)12/h1-8,15H
InChIKeyHDARKTZWNJILLT-UHFFFAOYSA-N
XLogP3.67
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-thieno[3,2-b]pyridin-7-ylphenol?
The IUPAC name of 4-thieno[3,2-b]pyridin-7-ylphenol (CID 166688050) is 4-thieno[3,2-b]pyridin-7-ylphenol.
What is the SMILES notation for 4-thieno[3,2-b]pyridin-7-ylphenol?
The canonical SMILES for 4-thieno[3,2-b]pyridin-7-ylphenol is Oc1ccc(-c2ccnc3ccsc23)cc1.
What is the InChIKey of 4-thieno[3,2-b]pyridin-7-ylphenol?
The InChIKey is HDARKTZWNJILLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NOS/c15-10-3-1-9(2-4-10)11-5-7-14-12-6-8-16-13(11)12/h1-8,15H.
What are the key properties of 4-thieno[3,2-b]pyridin-7-ylphenol?
4-thieno[3,2-b]pyridin-7-ylphenol has a molecular weight of 227.29 g/mol, XLogP of 3.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thieno[3,2-b]pyridin-7-ylphenol is sourced from PubChem (CID 166688050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).