2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine

C16H12ClNOS — CID 2807730

IUPAC2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine
SMILESCSc1cc(-c2ccc(Cl)cc2)nc(-c2ccco2)c1
InChIInChI=1S/C16H12ClNOS/c1-20-13-9-14(11-4-6-12(17)7-5-11)18-15(10-13)16-3-2-8-19-16/h2-10H,1H3
InChIKeyGSFSYUUQBYGOPC-UHFFFAOYSA-N
MW301.80 g/mol
LogP5.38
Rot. Bonds3

About 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine

2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine (PubChem CID 2807730) has the molecular formula C16H12ClNOS and a molecular weight of 301.80 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine
PubChem CID2807730
Molecular FormulaC16H12ClNOS
Molecular Weight301.80 g/mol
Exact Mass301.03
IUPAC Name2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine
SMILESCSc1cc(-c2ccc(Cl)cc2)nc(-c2ccco2)c1
InChIInChI=1S/C16H12ClNOS/c1-20-13-9-14(11-4-6-12(17)7-5-11)18-15(10-13)16-3-2-8-19-16/h2-10H,1H3
InChIKeyGSFSYUUQBYGOPC-UHFFFAOYSA-N
XLogP5.38
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.80
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine 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-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine?
The IUPAC name of 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine (CID 2807730) is 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine?
The canonical SMILES for 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine is CSc1cc(-c2ccc(Cl)cc2)nc(-c2ccco2)c1.
What is the InChIKey of 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine?
The InChIKey is GSFSYUUQBYGOPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNOS/c1-20-13-9-14(11-4-6-12(17)7-5-11)18-15(10-13)16-3-2-8-19-16/h2-10H,1H3.
What are the key properties of 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine?
2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine has a molecular weight of 301.80 g/mol, XLogP of 5.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-6-(furan-2-yl)-4-methylsulfanylpyridine is sourced from PubChem (CID 2807730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).