TL;DR: 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide (CAS 126106-46-5) is a chemical compound with molecular formula C5H6N2OS2 and molecular weight 173.99216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-hydroxy-1,3-thiazol-2-yl)ethanethioamide
Also Known As: 2-(4-hydroxy-1,3-thiazol-2-yl)ethanethioamide, hydroxythiazolylethanethioamide, 2-(4-Hydroxythiazol-2-yl)ethanethioamide, 4-hydroxy-2-Thiazoleethanethioamide, 3295AD
| Molecular Formula | C5H6N2OS2 |
| Molecular Weight | 173.99216 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.99216 Da |
| Heavy Atoms | 10 |
| Complexity | 142.0 |
| SMILES | C1=C(N=C(S1)CC(=S)N)O |
| InChIKey | LAQFXEPTZXJKAI-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide. Following Lipinski's Rule of Five, 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide has 2 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 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide is 126106-46-5.
The molecular formula of 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide is C5H6N2OS2.
The molecular weight of 2-(4-Hydroxy-1,3-thiazol-2-yl)ethanethioamide is 173.99216 g/mol.
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