西诺沙星
TL;DR: 西诺沙星 (CAS 28657-80-9) is a chemical compound with molecular formula C12H10N2O5 and molecular weight 262.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
西诺沙星
1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid
Also Known As: cinoxacin, Cinobac, Cinoxacino, Cinoxacinum, Cinoxacine
| Molecular Formula | C12H10N2O5 |
|---|---|
| Molecular Weight | 262.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 88.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.05896 |
| Heavy Atoms | 19 |
| Complexity | 449.0 |
| Melting Point | 261-262 |
| Solubility | 9.61e-01 g/L |
Chemical Identifiers
| CAS Number | 28657-80-9 |
|---|---|
| SMILES | CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)O)OCO3 |
| InChIKey | VDUWPHTZYNWKRN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
西诺沙星 (CAS 28657-80-9), with molecular formula C12H10N2O5 and molecular weight 262.06 g/mol. IUPAC: 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid.
Chemical Property Profile of 西诺沙星
Property Insights of 西诺沙星
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 西诺沙星. The TPSA of 88.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 西诺沙星. Following Lipinski's Rule of Five, 西诺沙星 has 1 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 西诺沙星?
The CAS number of 西诺沙星 is 28657-80-9.
What is the molecular formula of 西诺沙星?
The molecular formula of 西诺沙星 is C12H10N2O5.
What is the molecular weight of 西诺沙星?
The molecular weight of 西诺沙星 is 262.06 g/mol.
Where can I buy 西诺沙星?
You can request a quote for 西诺沙星 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 西诺沙星?
Yes, KEHONG BIO provides custom synthesis services for 西诺沙星 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.