TL;DR: Loxoprofen (CAS 68767-14-6) is a chemical compound with molecular formula C15H18O3 and molecular weight 246.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(2-oxocyclopentyl)methyl]phenyl]propanoic acid
Also Known As: Loxoprofen, Loxoprofene, Loxoprofeno, Koloxo, Loxoprofen acid
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H18O3 |
| Molecular Weight | 246.1256 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.1256 Da |
| Heavy Atoms | 18 |
| Complexity | 316.0 |
| Melting Point | 108.5 |
| Boiling Point | 220.7 |
| Solubility | 47 |
| SMILES | CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)O |
| InChIKey | YMBXTVYHTMGZDW-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Loxoprofen. With a topological polar surface area (TPSA) of 54.4 Ų, Loxoprofen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Loxoprofen has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Loxoprofen is 68767-14-6.
The molecular formula of Loxoprofen is C15H18O3.
The molecular weight of Loxoprofen is 246.1256 g/mol.
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