AQ-390/41639093
TL;DR: AQ-390/41639093 (CAS 518321-08-9) is a chemical compound with molecular formula C27H25NO6S and molecular weight 491.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[acetyl-(2,4-dimethylphenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate
Also Known As: AQ-390/41639093, ETHYL 5-[N-(2,4-DIMETHYLBENZENESULFONYL)ACETAMIDO]-2-PHENYL-1-BENZOFURAN-3-CARBOXYLATE, ethyl 5-{acetyl[(2,4-dimethylphenyl)sulfonyl]amino}-2-phenyl-1-benzofuran-3-carboxylate, F1269-1662, ethyl 5-(N-((2,4-dimethylphenyl)sulfonyl)acetamido)-2-phenylbenzofuran-3-carboxylate
| Molecular Formula | C27H25NO6S |
|---|---|
| Molecular Weight | 491.14 g/mol |
| LogP | 5.63514 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 491.14026 |
| Heavy Atoms | 35 |
| Complexity | 1536.9462 |
Chemical Identifiers
| CAS Number | 518321-08-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C)S(=O)(=O)C3=C(C=C(C=C3)C)C)C4=CC=CC=C4 |
Product Overview
AQ-390/41639093 (CAS 518321-08-9), with molecular formula C27H25NO6S and molecular weight 491.14 g/mol. IUPAC: ethyl 5-[acetyl-(2,4-dimethylphenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/41639093
Property Insights of AQ-390/41639093
The XLogP value of 5.63514 indicates that AQ-390/41639093 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-390/41639093. Following Lipinski's Rule of Five, AQ-390/41639093 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-390/41639093?
The CAS number of AQ-390/41639093 is 518321-08-9.
What is the molecular formula of AQ-390/41639093?
The molecular formula of AQ-390/41639093 is C27H25NO6S.
What is the molecular weight of AQ-390/41639093?
The molecular weight of AQ-390/41639093 is 491.14 g/mol.
Where can I buy AQ-390/41639093?
You can request a quote for AQ-390/41639093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/41639093?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/41639093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.