1-sulfanylidenethieno[3,2-b]pyridine

C7H5NS2 — CID 141378113

IUPAC1-sulfanylidenethieno[3,2-b]pyridine
SMILESS=S1C=Cc2ncccc21
InChIInChI=1S/C7H5NS2/c9-10-5-3-6-7(10)2-1-4-8-6/h1-5H
InChIKeyRFAYWWFTVROHBD-UHFFFAOYSA-N
MW167.26 g/mol
LogP1.50
Rot. Bonds

About 1-sulfanylidenethieno[3,2-b]pyridine

1-sulfanylidenethieno[3,2-b]pyridine (PubChem CID 141378113) has the molecular formula C7H5NS2 and a molecular weight of 167.26 g/mol. Its IUPAC name is 1-sulfanylidenethieno[3,2-b]pyridine.

Molecular Properties

Compound Name1-sulfanylidenethieno[3,2-b]pyridine
PubChem CID141378113
Molecular FormulaC7H5NS2
Molecular Weight167.26 g/mol
Exact Mass166.99
IUPAC Name1-sulfanylidenethieno[3,2-b]pyridine
SMILESS=S1C=Cc2ncccc21
InChIInChI=1S/C7H5NS2/c9-10-5-3-6-7(10)2-1-4-8-6/h1-5H
InChIKeyRFAYWWFTVROHBD-UHFFFAOYSA-N
XLogP1.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.26
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-sulfanylidenethieno[3,2-b]pyridine?
The IUPAC name of 1-sulfanylidenethieno[3,2-b]pyridine (CID 141378113) is 1-sulfanylidenethieno[3,2-b]pyridine.
What is the SMILES notation for 1-sulfanylidenethieno[3,2-b]pyridine?
The canonical SMILES for 1-sulfanylidenethieno[3,2-b]pyridine is S=S1C=Cc2ncccc21.
What is the InChIKey of 1-sulfanylidenethieno[3,2-b]pyridine?
The InChIKey is RFAYWWFTVROHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NS2/c9-10-5-3-6-7(10)2-1-4-8-6/h1-5H.
What are the key properties of 1-sulfanylidenethieno[3,2-b]pyridine?
1-sulfanylidenethieno[3,2-b]pyridine has a molecular weight of 167.26 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-sulfanylidenethieno[3,2-b]pyridine is sourced from PubChem (CID 141378113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).