TL;DR: Temafloxacin (CAS 108319-06-8) is a chemical compound with molecular formula C21H18F3N3O3 and molecular weight 417.13004 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-difluorophenyl)-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
Also Known As: Temafloxacin, Temafloxacine, Omniflox, Temafloxacinum, Temafloxacina
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H18F3N3O3 |
| Molecular Weight | 417.13004 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.13004 Da |
| Heavy Atoms | 30 |
| Complexity | 721.0 |
| SMILES | CC1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=C(C=C(C=C4)F)F)F |
| InChIKey | QKDHBVNJCZBTMR-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Temafloxacin. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Temafloxacin. Following Lipinski's Rule of Five, Temafloxacin has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Temafloxacin is 108319-06-8.
The molecular formula of Temafloxacin is C21H18F3N3O3.
The molecular weight of Temafloxacin is 417.13004 g/mol.
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