TL;DR: Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- (CAS 104907-30-4) is a chemical compound with molecular formula C17H13NO2S and molecular weight 295.0667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(2-phenyl-1,3-thiazol-4-yl)phenyl]acetic acid
Also Known As: KST-1A0688, [2-(2-phenyl-1,3-thiazol-4-yl)phenyl]acetic acid, Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)-, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)acetic acid, 2-[2-(2-phenyl-1,3-thiazol-4-yl)phenyl]acetic Acid
| Molecular Formula | C17H13NO2S |
| Molecular Weight | 295.0667 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0667 Da |
| Heavy Atoms | 21 |
| Complexity | 357.0 |
| SMILES | C1=CC=C(C=C1)C2=NC(=CS2)C3=CC=CC=C3CC(=O)O |
| InChIKey | ZKLJGIXRFTUWGR-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)-. Following Lipinski's Rule of Five, Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- 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 Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- is 104907-30-4.
The molecular formula of Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- is C17H13NO2S.
The molecular weight of Acetic acid, 2-(2-(2-phenyl-1,3-thiazol-4-yl)phenyl)- is 295.0667 g/mol.
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