AQ-390/42708518
TL;DR: AQ-390/42708518 (CAS 706769-04-2) is a chemical compound with molecular formula C20H18FNO6S and molecular weight 419.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[acetyl-(4-fluoro-2-methylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: AQ-390/42708518, methyl 5-(N-((4-fluoro-2-methylphenyl)sulfonyl)acetamido)-2-methylbenzofuran-3-carboxylate, F1566-1286, methyl 5-[acetyl-(4-fluoro-2-methylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate, METHYL 5-[N-(4-FLUORO-2-METHYLBENZENESULFONYL)ACETAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE
| Molecular Formula | C20H18FNO6S |
|---|---|
| Molecular Weight | 419.08 g/mol |
| LogP | 3.71714 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.0839 |
| Heavy Atoms | 29 |
| Complexity | 1245.3351 |
Chemical Identifiers
| CAS Number | 706769-04-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)F)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C |
Product Overview
AQ-390/42708518 (CAS 706769-04-2), with molecular formula C20H18FNO6S and molecular weight 419.08 g/mol. IUPAC: methyl 5-[acetyl-(4-fluoro-2-methylphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/42708518
Property Insights of AQ-390/42708518
The XLogP value of 3.71714 indicates that AQ-390/42708518 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-390/42708518. Following Lipinski's Rule of Five, AQ-390/42708518 has 0 hydrogen bond donor(s) and 6 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 AQ-390/42708518?
The CAS number of AQ-390/42708518 is 706769-04-2.
What is the molecular formula of AQ-390/42708518?
The molecular formula of AQ-390/42708518 is C20H18FNO6S.
What is the molecular weight of AQ-390/42708518?
The molecular weight of AQ-390/42708518 is 419.08 g/mol.
Where can I buy AQ-390/42708518?
You can request a quote for AQ-390/42708518 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/42708518?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/42708518 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.