TL;DR: 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide (CAS 125287-43-6) is a chemical compound with molecular formula C4H7NO4S2 and molecular weight 196.98164 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1-dioxo-2,5-dihydrothiophene-3-sulfonamide
Also Known As: 1,1-dioxo-2,5-dihydrothiophene-3-sulfonamide, 3-Thiophenesulfonamide,2,5-dihydro-,1,1-dioxide(9CI), 3-amidosulfonyl-3-thiolene-1,1-dioxide, 2,5-dihydrothiophene-3-sulfonamide 1,1-dioxide, 2,5-dihydrothiophene-3-sulfonamide1,1-dioxide
| Molecular Formula | C4H7NO4S2 |
| Molecular Weight | 196.98164 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.98164 Da |
| Heavy Atoms | 11 |
| Complexity | 377.0 |
| SMILES | C1C=C(CS1(=O)=O)S(=O)(=O)N |
| InChIKey | XWANHAZFNXUEAY-UHFFFAOYSA-N |
The XLogP value of -1.9 indicates that 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide. Following Lipinski's Rule of Five, 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide is 125287-43-6.
The molecular formula of 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide is C4H7NO4S2.
The molecular weight of 1,1-Dioxo-2,5-dihydrothiophene-3-sulfonamide is 196.98164 g/mol.
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