About 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide
2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 7254249) has the molecular formula C11H9ClN2O3S2
and a molecular weight of 316.79 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide.
Molecular Properties
| Compound Name | 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide |
| PubChem CID | 7254249 |
| Molecular Formula | C11H9ClN2O3S2 |
| Molecular Weight | 316.79 g/mol |
| Exact Mass | 315.97 |
| IUPAC Name | 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide |
| SMILES | O=C(CS(=O)(=O)c1ccc(Cl)cc1)Nc1nccs1 |
| InChI | InChI=1S/C11H9ClN2O3S2/c12-8-1-3-9(4-2-8)19(16,17)7-10(15)14-11-13-5-6-18-11/h1-6H,7H2,(H,13,14,15) |
| InChIKey | HEJUZJXSCVRQTC-UHFFFAOYSA-N |
| XLogP | 2.21 |
| TPSA | 76.13 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 316.79 |
| LogP ≤ 5 | 2.21 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide (CID 7254249) is 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide is O=C(CS(=O)(=O)c1ccc(Cl)cc1)Nc1nccs1.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is HEJUZJXSCVRQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN2O3S2/c12-8-1-3-9(4-2-8)19(16,17)7-10(15)14-11-13-5-6-18-11/h1-6H,7H2,(H,13,14,15).
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide?
2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 316.79 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 7254249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).