About 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine
4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine (PubChem CID 46229228) has the molecular formula C19H11Cl2NOS
and a molecular weight of 372.28 g/mol. Its IUPAC name is 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine.
Molecular Properties
| Compound Name | 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine |
| PubChem CID | 46229228 |
| Molecular Formula | C19H11Cl2NOS |
| Molecular Weight | 372.28 g/mol |
| Exact Mass | 370.99 |
| IUPAC Name | 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine |
| SMILES | Clc1ccc(-c2cc(-c3cccs3)nc(-c3ccccc3Cl)c2)o1 |
| InChI | InChI=1S/C19H11Cl2NOS/c20-14-5-2-1-4-13(14)15-10-12(17-7-8-19(21)23-17)11-16(22-15)18-6-3-9-24-18/h1-11H |
| InChIKey | CIMYTMNXCRGZJJ-UHFFFAOYSA-N |
| XLogP | 7.04 |
| TPSA | 26.03 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 372.28 |
| LogP ≤ 5 | 7.04 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine?
The IUPAC name of 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine (CID 46229228) is 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine.
What is the SMILES notation for 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine?
The canonical SMILES for 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine is Clc1ccc(-c2cc(-c3cccs3)nc(-c3ccccc3Cl)c2)o1.
What is the InChIKey of 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine?
The InChIKey is CIMYTMNXCRGZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11Cl2NOS/c20-14-5-2-1-4-13(14)15-10-12(17-7-8-19(21)23-17)11-16(22-15)18-6-3-9-24-18/h1-11H.
What are the key properties of 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine?
4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine 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 4-(5-chlorofuran-2-yl)-2-(2-chlorophenyl)-6-thiophen-2-ylpyridine is sourced from PubChem (CID 46229228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).