Robenacoxib
TL;DR: Robenacoxib (CAS 220991-32-2) is a chemical compound with molecular formula C16H13F4NO2 and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-ethyl-2-(2,3,5,6-tetrafluoroanilino)phenyl]acetic acid
Also Known As: Robenacoxib, Onsior, robenacoxibum, Robenacoxib [INN], onsior injection
| Molecular Formula | C16H13F4NO2 |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 4.1761 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.08823 |
| Heavy Atoms | 23 |
| Complexity | 735.98083 |
Chemical Identifiers
| CAS Number | 220991-32-2 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1)NC2=C(C(=CC(=C2F)F)F)F)CC(=O)O |
Product Overview
Robenacoxib (CAS 220991-32-2), with molecular formula C16H13F4NO2 and molecular weight 327.09 g/mol. IUPAC: 2-[5-ethyl-2-(2,3,5,6-tetrafluoroanilino)phenyl]acetic acid.
Chemical Property Profile of Robenacoxib
Property Insights of Robenacoxib
The XLogP value of 4.1761 indicates that Robenacoxib is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, Robenacoxib exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Robenacoxib has 2 hydrogen bond donor(s) and 2 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 Robenacoxib?
The CAS number of Robenacoxib is 220991-32-2.
What is the molecular formula of Robenacoxib?
The molecular formula of Robenacoxib is C16H13F4NO2.
What is the molecular weight of Robenacoxib?
The molecular weight of Robenacoxib is 327.09 g/mol.
Where can I buy Robenacoxib?
You can request a quote for Robenacoxib directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Robenacoxib?
Yes, KEHONG BIO provides custom synthesis services for Robenacoxib and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.