About 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide
4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide (PubChem CID 103886271) has the molecular formula C11H8Cl2N2O2S
and a molecular weight of 303.17 g/mol. Its IUPAC name is 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide.
Molecular Properties
| Compound Name | 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide |
| PubChem CID | 103886271 |
| Molecular Formula | C11H8Cl2N2O2S |
| Molecular Weight | 303.17 g/mol |
| Exact Mass | 301.97 |
| IUPAC Name | 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide |
| SMILES | O=S(=O)(Nc1ncccc1Cl)c1ccc(Cl)cc1 |
| InChI | InChI=1S/C11H8Cl2N2O2S/c12-8-3-5-9(6-4-8)18(16,17)15-11-10(13)2-1-7-14-11/h1-7H,(H,14,15) |
| InChIKey | AHZUATFRIDRJNC-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 59.06 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 303.17 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide?
The IUPAC name of 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide (CID 103886271) is 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide?
The canonical SMILES for 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1ncccc1Cl)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide?
The InChIKey is AHZUATFRIDRJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2N2O2S/c12-8-3-5-9(6-4-8)18(16,17)15-11-10(13)2-1-7-14-11/h1-7H,(H,14,15).
What are the key properties of 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide?
4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide has a molecular weight of 303.17 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-chloro-2-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 103886271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).