5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine

C19H12ClNOS — CID 102405379

IUPAC5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine
SMILESClc1ccc(-c2cnc(-c3cccs3)cc2-c2ccco2)cc1
InChIInChI=1S/C19H12ClNOS/c20-14-7-5-13(6-8-14)16-12-21-17(19-4-2-10-23-19)11-15(16)18-3-1-9-22-18/h1-12H
InChIKeyRETNECZOYJXUDA-UHFFFAOYSA-N
MW337.83 g/mol
LogP6.39
Rot. Bonds3

About 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine

5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine (PubChem CID 102405379) has the molecular formula C19H12ClNOS and a molecular weight of 337.83 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine.

Molecular Properties

Compound Name5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine
PubChem CID102405379
Molecular FormulaC19H12ClNOS
Molecular Weight337.83 g/mol
Exact Mass337.03
IUPAC Name5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine
SMILESClc1ccc(-c2cnc(-c3cccs3)cc2-c2ccco2)cc1
InChIInChI=1S/C19H12ClNOS/c20-14-7-5-13(6-8-14)16-12-21-17(19-4-2-10-23-19)11-15(16)18-3-1-9-22-18/h1-12H
InChIKeyRETNECZOYJXUDA-UHFFFAOYSA-N
XLogP6.39
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.83
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine 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 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine?
The IUPAC name of 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine (CID 102405379) is 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine.
What is the SMILES notation for 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine?
The canonical SMILES for 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine is Clc1ccc(-c2cnc(-c3cccs3)cc2-c2ccco2)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine?
The InChIKey is RETNECZOYJXUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClNOS/c20-14-7-5-13(6-8-14)16-12-21-17(19-4-2-10-23-19)11-15(16)18-3-1-9-22-18/h1-12H.
What are the key properties of 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine?
5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine has a molecular weight of 337.83 g/mol, XLogP of 6.39, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-4-(furan-2-yl)-2-thiophen-2-ylpyridine is sourced from PubChem (CID 102405379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).