thieno[3,2-b]furan-6-ol

C6H4O2S — CID 22090606

IUPACthieno[3,2-b]furan-6-ol
SMILESOc1csc2ccoc12
InChIInChI=1S/C6H4O2S/c7-4-3-9-5-1-2-8-6(4)5/h1-3,7H
InChIKeyLLCVZNPAUGUVIA-UHFFFAOYSA-N
MW140.16 g/mol
LogP2.20
Rot. Bonds

About thieno[3,2-b]furan-6-ol

thieno[3,2-b]furan-6-ol (PubChem CID 22090606) has the molecular formula C6H4O2S and a molecular weight of 140.16 g/mol. Its IUPAC name is thieno[3,2-b]furan-6-ol.

Molecular Properties

Compound Namethieno[3,2-b]furan-6-ol
PubChem CID22090606
Molecular FormulaC6H4O2S
Molecular Weight140.16 g/mol
Exact Mass139.99
IUPAC Namethieno[3,2-b]furan-6-ol
SMILESOc1csc2ccoc12
InChIInChI=1S/C6H4O2S/c7-4-3-9-5-1-2-8-6(4)5/h1-3,7H
InChIKeyLLCVZNPAUGUVIA-UHFFFAOYSA-N
XLogP2.20
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.16
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of thieno[3,2-b]furan-6-ol?
The IUPAC name of thieno[3,2-b]furan-6-ol (CID 22090606) is thieno[3,2-b]furan-6-ol.
What is the SMILES notation for thieno[3,2-b]furan-6-ol?
The canonical SMILES for thieno[3,2-b]furan-6-ol is Oc1csc2ccoc12.
What is the InChIKey of thieno[3,2-b]furan-6-ol?
The InChIKey is LLCVZNPAUGUVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4O2S/c7-4-3-9-5-1-2-8-6(4)5/h1-3,7H.
What are the key properties of thieno[3,2-b]furan-6-ol?
thieno[3,2-b]furan-6-ol has a molecular weight of 140.16 g/mol, XLogP of 2.20, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[3,2-b]furan-6-ol is sourced from PubChem (CID 22090606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).