AQ-390/41639114
TL;DR: AQ-390/41639114 (CAS 518319-29-4) is a chemical compound with molecular formula C25H20FNO6S and molecular weight 481.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[acetyl-(4-fluorophenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate
Also Known As: AQ-390/41639114, ethyl 5-{acetyl[(4-fluorophenyl)sulfonyl]amino}-2-phenyl-1-benzofuran-3-carboxylate, ethyl 5-[acetyl-(4-fluorophenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate, ETHYL 5-[N-(4-FLUOROBENZENESULFONYL)ACETAMIDO]-2-PHENYL-1-BENZOFURAN-3-CARBOXYLATE
| Molecular Formula | C25H20FNO6S |
|---|---|
| Molecular Weight | 481.10 g/mol |
| LogP | 5.1574 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 481.09955 |
| Heavy Atoms | 34 |
| Complexity | 1477.3817 |
Chemical Identifiers
| CAS Number | 518319-29-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C)S(=O)(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4 |
Product Overview
AQ-390/41639114 (CAS 518319-29-4), with molecular formula C25H20FNO6S and molecular weight 481.10 g/mol. IUPAC: ethyl 5-[acetyl-(4-fluorophenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/41639114
Property Insights of AQ-390/41639114
The XLogP value of 5.1574 indicates that AQ-390/41639114 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.89 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-390/41639114. Following Lipinski's Rule of Five, AQ-390/41639114 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AQ-390/41639114?
The CAS number of AQ-390/41639114 is 518319-29-4.
What is the molecular formula of AQ-390/41639114?
The molecular formula of AQ-390/41639114 is C25H20FNO6S.
What is the molecular weight of AQ-390/41639114?
The molecular weight of AQ-390/41639114 is 481.10 g/mol.
Where can I buy AQ-390/41639114?
You can request a quote for AQ-390/41639114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/41639114?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/41639114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.