AQ-390/40898124
TL;DR: AQ-390/40898124 (CAS 421580-06-5) is a chemical compound with molecular formula C23H21NO5S and molecular weight 423.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(2,4-dimethylphenyl)sulfonylamino]-2-methylbenzo[g][1]benzofuran-3-carboxylate
Also Known As: AQ-390/40898124, METHYL 5-(2,4-DIMETHYLBENZENESULFONAMIDO)-2-METHYLNAPHTHO[1,2-B]FURAN-3-CARBOXYLATE, F1113-0627, methyl 5-[(2,4-dimethylphenyl)sulfonylamino]-2-methylbenzo[g][1]benzofuran-3-carboxylate, methyl 5-{[(2,4-dimethylphenyl)sulfonyl]amino}-2-methylnaphtho[1,2-b]furan-3-carboxylate
| Molecular Formula | C23H21NO5S |
|---|---|
| Molecular Weight | 423.11 g/mol |
| LogP | 5.09866 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.11404 |
| Heavy Atoms | 30 |
| Complexity | 1416.8292 |
Chemical Identifiers
| CAS Number | 421580-06-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)NC2=CC3=C(C4=CC=CC=C42)OC(=C3C(=O)OC)C)C |
Product Overview
AQ-390/40898124 (CAS 421580-06-5), with molecular formula C23H21NO5S and molecular weight 423.11 g/mol. IUPAC: methyl 5-[(2,4-dimethylphenyl)sulfonylamino]-2-methylbenzo[g][1]benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/40898124
Property Insights of AQ-390/40898124
The XLogP value of 5.09866 indicates that AQ-390/40898124 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-390/40898124. Following Lipinski's Rule of Five, AQ-390/40898124 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AQ-390/40898124?
The CAS number of AQ-390/40898124 is 421580-06-5.
What is the molecular formula of AQ-390/40898124?
The molecular formula of AQ-390/40898124 is C23H21NO5S.
What is the molecular weight of AQ-390/40898124?
The molecular weight of AQ-390/40898124 is 423.11 g/mol.
Where can I buy AQ-390/40898124?
You can request a quote for AQ-390/40898124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/40898124?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/40898124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.