TL;DR: Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate (CAS 1015533-46-6) is a chemical compound with molecular formula C9H6NNaO2S2 and molecular weight 246.97377 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
sodium 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetate
Also Known As: sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate, sodium (2-thien-2-yl-1,3-thiazol-4-yl)acetate, sodium;2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetate, sodium;2-[2-(2-thienyl)thiazol-4-yl]acetate, Sodium 2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetate
| Molecular Formula | C9H6NNaO2S2 |
| Molecular Weight | 246.97377 g/mol |
| XLogP | -1.832 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.97377 Da |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
| SMILES | C1=CSC(=C1)C2=NC(=CS2)CC(=O)[O-].[Na+] |
| InChIKey | QCLXCYXRUBTRGF-UHFFFAOYSA-M |
The XLogP value of -1.832 indicates that Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate. Following Lipinski's Rule of Five, Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate has 0 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 Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate is 1015533-46-6.
The molecular formula of Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate is C9H6NNaO2S2.
The molecular weight of Sodium 2-[2-(thiophen-2-yl)-1,3-thiazol-4-yl]acetate is 246.97377 g/mol.
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