碘克西胺乙酯
TL;DR: 碘克西胺乙酯 (CAS 53882-13-6) is a chemical compound with molecular formula C15H14ClN3O6 and molecular weight 367.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
碘克西胺乙酯
ethyl 2-[2-chloro-5-cyano-3-[(2-ethoxy-2-oxoacetyl)amino]anilino]-2-oxoacetate
Also Known As: LODOXAMIDE ETHYL, Lodoxamide, lodoxamideethyl, Lodoxamide Diethyl Ester, Lodoxamide diethyl
| Molecular Formula | C15H14ClN3O6 |
|---|---|
| Molecular Weight | 367.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 367.0571 |
| Heavy Atoms | 25 |
| Complexity | 545.0 |
Chemical Identifiers
| CAS Number | 53882-13-6 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=CC(=CC(=C1Cl)NC(=O)C(=O)OCC)C#N |
| InChIKey | BNTAPIYHWPPFBW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
碘克西胺乙酯 (CAS 53882-13-6), with molecular formula C15H14ClN3O6 and molecular weight 367.06 g/mol. IUPAC: ethyl 2-[2-chloro-5-cyano-3-[(2-ethoxy-2-oxoacetyl)amino]anilino]-2-oxoacetate.
Chemical Property Profile of 碘克西胺乙酯
Property Insights of 碘克西胺乙酯
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 碘克西胺乙酯. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 碘克西胺乙酯. Following Lipinski's Rule of Five, 碘克西胺乙酯 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 碘克西胺乙酯?
The CAS number of 碘克西胺乙酯 is 53882-13-6.
What is the molecular formula of 碘克西胺乙酯?
The molecular formula of 碘克西胺乙酯 is C15H14ClN3O6.
What is the molecular weight of 碘克西胺乙酯?
The molecular weight of 碘克西胺乙酯 is 367.06 g/mol.
Where can I buy 碘克西胺乙酯?
You can request a quote for 碘克西胺乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 碘克西胺乙酯?
Yes, KEHONG BIO provides custom synthesis services for 碘克西胺乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.