TL;DR: 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one (CAS 127378-37-4) is a chemical compound with molecular formula C8H4BrNOS3 and molecular weight 304.86383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(5-bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-[(5-Bromo-2-thienyl)methylene]-2-thioxo-4-thiazolidinone, 5-(5-bromo-thiophen-2-ylmethylene)-2-thioxo-thiazolidin-4-one, 5-[(5-bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-5-[(5-BROMOTHIEN-2-YL)METHYLENE]-2-MERCAPTO-1,3-THIAZOL-4(5H)-ONE
| Molecular Formula | C8H4BrNOS3 |
| Molecular Weight | 304.86383 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 304.86383 Da |
| Heavy Atoms | 14 |
| Complexity | 318.0 |
| SMILES | C1=C(SC(=C1)Br)C=C2C(=O)NC(=S)S2 |
| InChIKey | FXJZQFCLIBCBAT-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one. Following Lipinski's Rule of Five, 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is 127378-37-4.
The molecular formula of 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is C8H4BrNOS3.
The molecular weight of 5-[(5-Bromothiophen-2-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one is 304.86383 g/mol.
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