8-Desfluoro-lomefloxacin
TL;DR: 8-Desfluoro-lomefloxacin (CAS 98079-47-1) is a chemical compound with molecular formula C17H20FN3O3 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
Also Known As: Lemefloxacin, Quinolone der., 8-Desfluorolomefloxacin, 8-DESFLUORO-LOMEFLOXACIN, 1-ethyl-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
| Molecular Formula | C17H20FN3O3 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.14886 |
| Heavy Atoms | 24 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 98079-47-1 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCNC(C3)C)F)C(=O)O |
| InChIKey | PXZDLINBBKAIPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-Desfluoro-lomefloxacin (CAS 98079-47-1), with molecular formula C17H20FN3O3 and molecular weight 333.15 g/mol. IUPAC: 1-ethyl-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of 8-Desfluoro-lomefloxacin
Property Insights of 8-Desfluoro-lomefloxacin
The XLogP value of -0.8 indicates that 8-Desfluoro-lomefloxacin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Desfluoro-lomefloxacin. Following Lipinski's Rule of Five, 8-Desfluoro-lomefloxacin has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Desfluoro-lomefloxacin?
The CAS number of 8-Desfluoro-lomefloxacin is 98079-47-1.
What is the molecular formula of 8-Desfluoro-lomefloxacin?
The molecular formula of 8-Desfluoro-lomefloxacin is C17H20FN3O3.
What is the molecular weight of 8-Desfluoro-lomefloxacin?
The molecular weight of 8-Desfluoro-lomefloxacin is 333.15 g/mol.
Where can I buy 8-Desfluoro-lomefloxacin?
You can request a quote for 8-Desfluoro-lomefloxacin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Desfluoro-lomefloxacin?
Yes, KEHONG BIO provides custom synthesis services for 8-Desfluoro-lomefloxacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.