克林沙星
TL;DR: 克林沙星 (CAS 105956-97-6) is a chemical compound with molecular formula C17H17ClFN3O3 and molecular weight 365.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
克林沙星
7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
Also Known As: CLINAFLOXACIN, clinafloxacine, clinafloxacino, clinafloxacinum, Clinafloxacin [INN]
| Molecular Formula | C17H17ClFN3O3 |
|---|---|
| Molecular Weight | 365.09 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 86.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.09424 |
| Heavy Atoms | 25 |
| Complexity | 626.0 |
| Solubility | >54.9 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 105956-97-6 |
|---|---|
| SMILES | C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)N4CCC(C4)N)F)C(=O)O |
| InChIKey | QGPKADBNRMWEQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
克林沙星 (CAS 105956-97-6), with molecular formula C17H17ClFN3O3 and molecular weight 365.09 g/mol. IUPAC: 7-(3-aminopyrrolidin-1-yl)-8-chloro-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of 克林沙星
Property Insights of 克林沙星
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 克林沙星. The TPSA of 86.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 克林沙星. Following Lipinski's Rule of Five, 克林沙星 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 克林沙星?
The CAS number of 克林沙星 is 105956-97-6.
What is the molecular formula of 克林沙星?
The molecular formula of 克林沙星 is C17H17ClFN3O3.
What is the molecular weight of 克林沙星?
The molecular weight of 克林沙星 is 365.09 g/mol.
Where can I buy 克林沙星?
You can request a quote for 克林沙星 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 克林沙星?
Yes, KEHONG BIO provides custom synthesis services for 克林沙星 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.