TL;DR: 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid (CAS 863669-69-6) is a chemical compound with molecular formula C9H7NO2S2 and molecular weight 224.99182 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetic acid
Also Known As: 2-[2-(thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid, (2-thien-3-yl-1,3-thiazol-4-yl)acetic acid, 2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetic Acid, AB00754866-01, 2-2-(thiophen-3-yl)-1,3-thiazol-4-ylacetic Acid
| Molecular Formula | C9H7NO2S2 |
| Molecular Weight | 224.99182 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.99182 Da |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
| SMILES | C1=CSC=C1C2=NC(=CS2)CC(=O)O |
| InChIKey | SRJPLNCSOGDLEC-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid. Following Lipinski's Rule of Five, 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid 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 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid is 863669-69-6.
The molecular formula of 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid is C9H7NO2S2.
The molecular weight of 2-[2-(Thiophen-3-yl)-1,3-thiazol-4-yl]acetic acid is 224.99182 g/mol.
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