Polmacoxib
TL;DR: Polmacoxib (CAS 1427301-99-2) is a chemical compound with molecular formula C18H16FNO4S and molecular weight 361.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide
Also Known As: Polmacoxib, acelex, polmacoxibum, Polmacoxib [USAN], Acelex (S. Korea)
| Molecular Formula | C18H16FNO4S |
|---|---|
| Molecular Weight | 361.08 g/mol |
| LogP | 2.7193 |
| Topological Polar Surface Area | 86.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.0784 |
| Heavy Atoms | 25 |
| Complexity | 991.9911 |
Chemical Identifiers
| CAS Number | 1427301-99-2 |
|---|---|
| SMILES | CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=CC=C3)F)C |
Product Overview
Polmacoxib (CAS 1427301-99-2), with molecular formula C18H16FNO4S and molecular weight 361.08 g/mol. IUPAC: 4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide.
Chemical Property Profile of Polmacoxib
Property Insights of Polmacoxib
The XLogP value of 2.7193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Polmacoxib. The TPSA of 86.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Polmacoxib. Following Lipinski's Rule of Five, Polmacoxib has 1 hydrogen bond donor(s) and 4 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 Polmacoxib?
The CAS number of Polmacoxib is 1427301-99-2.
What is the molecular formula of Polmacoxib?
The molecular formula of Polmacoxib is C18H16FNO4S.
What is the molecular weight of Polmacoxib?
The molecular weight of Polmacoxib is 361.08 g/mol.
Where can I buy Polmacoxib?
You can request a quote for Polmacoxib directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polmacoxib?
Yes, KEHONG BIO provides custom synthesis services for Polmacoxib and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.