2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine

C19H11Cl2NOS — CID 46229597

IUPAC2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine
SMILESClc1ccc(-c2cc(-c3ccco3)cc(-c3ccc(Cl)s3)n2)cc1
InChIInChI=1S/C19H11Cl2NOS/c20-14-5-3-12(4-6-14)15-10-13(17-2-1-9-23-17)11-16(22-15)18-7-8-19(21)24-18/h1-11H
InChIKeyMLTJSBVTADPXRP-UHFFFAOYSA-N
MW372.28 g/mol
LogP7.04
Rot. Bonds3

About 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine

2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine (PubChem CID 46229597) has the molecular formula C19H11Cl2NOS and a molecular weight of 372.28 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine
PubChem CID46229597
Molecular FormulaC19H11Cl2NOS
Molecular Weight372.28 g/mol
Exact Mass370.99
IUPAC Name2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine
SMILESClc1ccc(-c2cc(-c3ccco3)cc(-c3ccc(Cl)s3)n2)cc1
InChIInChI=1S/C19H11Cl2NOS/c20-14-5-3-12(4-6-14)15-10-13(17-2-1-9-23-17)11-16(22-15)18-7-8-19(21)24-18/h1-11H
InChIKeyMLTJSBVTADPXRP-UHFFFAOYSA-N
XLogP7.04
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.28
LogP ≤ 57.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine?
The IUPAC name of 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine (CID 46229597) is 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine.
What is the SMILES notation for 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine?
The canonical SMILES for 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine is Clc1ccc(-c2cc(-c3ccco3)cc(-c3ccc(Cl)s3)n2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine?
The InChIKey is MLTJSBVTADPXRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2NOS/c20-14-5-3-12(4-6-14)15-10-13(17-2-1-9-23-17)11-16(22-15)18-7-8-19(21)24-18/h1-11H.
What are the key properties of 2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine?
2-(4-chlorophenyl)-6-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine has a molecular weight of 372.28 g/mol, XLogP of 7.04, 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-(5-chlorothiophen-2-yl)-4-(furan-2-yl)pyridine is sourced from PubChem (CID 46229597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).