2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine

C12H12N2S2 — CID 11586853

IUPAC2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine
SMILESCSc1cccc(-c2cccc(SC)n2)n1
InChIInChI=1S/C12H12N2S2/c1-15-11-7-3-5-9(13-11)10-6-4-8-12(14-10)16-2/h3-8H,1-2H3
InChIKeyZMAGQTSLWCOACC-UHFFFAOYSA-N
MW248.38 g/mol
LogP3.59
Rot. Bonds3

About 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine

2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine (PubChem CID 11586853) has the molecular formula C12H12N2S2 and a molecular weight of 248.38 g/mol. Its IUPAC name is 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine.

Molecular Properties

Compound Name2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine
PubChem CID11586853
Molecular FormulaC12H12N2S2
Molecular Weight248.38 g/mol
Exact Mass248.04
IUPAC Name2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine
SMILESCSc1cccc(-c2cccc(SC)n2)n1
InChIInChI=1S/C12H12N2S2/c1-15-11-7-3-5-9(13-11)10-6-4-8-12(14-10)16-2/h3-8H,1-2H3
InChIKeyZMAGQTSLWCOACC-UHFFFAOYSA-N
XLogP3.59
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.38
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine?
The IUPAC name of 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine (CID 11586853) is 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine.
What is the SMILES notation for 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine?
The canonical SMILES for 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine is CSc1cccc(-c2cccc(SC)n2)n1.
What is the InChIKey of 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine?
The InChIKey is ZMAGQTSLWCOACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2S2/c1-15-11-7-3-5-9(13-11)10-6-4-8-12(14-10)16-2/h3-8H,1-2H3.
What are the key properties of 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine?
2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine has a molecular weight of 248.38 g/mol, XLogP of 3.59, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfanyl-6-(6-methylsulfanyl-2-pyridinyl)pyridine is sourced from PubChem (CID 11586853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).