AQ-390/42425587
TL;DR: AQ-390/42425587 (CAS 361179-55-7) is a chemical compound with molecular formula C21H23NO6S and molecular weight 417.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-[(4-ethoxyphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: AQ-390/42425587, propan-2-yl 5-(4-ethoxybenzenesulfonamido)-2-methyl-1-benzofuran-3-carboxylate, isopropyl 5-(4-ethoxyphenylsulfonamido)-2-methylbenzofuran-3-carboxylate, isopropyl 5-{[(4-ethoxyphenyl)sulfonyl]amino}-2-methyl-1-benzofuran-3-carboxylate, F0808-0117
| Molecular Formula | C21H23NO6S |
|---|---|
| Molecular Weight | 417.12 g/mol |
| LogP | 4.50592 |
| Topological Polar Surface Area | 94.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.1246 |
| Heavy Atoms | 29 |
| Complexity | 1129.9377 |
Chemical Identifiers
| CAS Number | 361179-55-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)OC(=C3C(=O)OC(C)C)C |
Product Overview
AQ-390/42425587 (CAS 361179-55-7), with molecular formula C21H23NO6S and molecular weight 417.12 g/mol. IUPAC: propan-2-yl 5-[(4-ethoxyphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/42425587
Property Insights of AQ-390/42425587
The XLogP value of 4.50592 indicates that AQ-390/42425587 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-390/42425587. Following Lipinski's Rule of Five, AQ-390/42425587 has 1 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-390/42425587?
The CAS number of AQ-390/42425587 is 361179-55-7.
What is the molecular formula of AQ-390/42425587?
The molecular formula of AQ-390/42425587 is C21H23NO6S.
What is the molecular weight of AQ-390/42425587?
The molecular weight of AQ-390/42425587 is 417.12 g/mol.
Where can I buy AQ-390/42425587?
You can request a quote for AQ-390/42425587 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/42425587?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/42425587 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.