司氟沙星
TL;DR: 司氟沙星 (CAS 110871-86-8) is a chemical compound with molecular formula C19H22F2N4O3 and molecular weight 392.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
司氟沙星
5-amino-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid
Also Known As: sparfloxacin, Zagam, CI 978, AT 4140, H696
| Molecular Formula | C19H22F2N4O3 |
|---|---|
| Molecular Weight | 392.17 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 392.166 |
| Heavy Atoms | 28 |
| Complexity | 691.0 |
Chemical Identifiers
| CAS Number | 110871-86-8 |
|---|---|
| SMILES | CC1CN(CC(N1)C)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N)F |
| InChIKey | DZZWHBIBMUVIIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
司氟沙星 (CAS 110871-86-8), with molecular formula C19H22F2N4O3 and molecular weight 392.17 g/mol. IUPAC: 5-amino-1-cyclopropyl-7-(3,5-dimethylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of 司氟沙星
Property Insights of 司氟沙星
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 司氟沙星. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 司氟沙星. Following Lipinski's Rule of Five, 司氟沙星 has 3 hydrogen bond donor(s) and 9 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 司氟沙星?
The CAS number of 司氟沙星 is 110871-86-8.
What is the molecular formula of 司氟沙星?
The molecular formula of 司氟沙星 is C19H22F2N4O3.
What is the molecular weight of 司氟沙星?
The molecular weight of 司氟沙星 is 392.17 g/mol.
Where can I buy 司氟沙星?
You can request a quote for 司氟沙星 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 司氟沙星?
Yes, KEHONG BIO provides custom synthesis services for 司氟沙星 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.