AQ-390/41640446
TL;DR: AQ-390/41640446 (CAS 477487-68-6) is a chemical compound with molecular formula C21H21Cl2NO5S and molecular weight 469.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 5-[(2,5-dichlorophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: AQ-390/41640446, PENTYL 5-(2,5-DICHLOROBENZENESULFONAMIDO)-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE, pentyl 5-{[(2,5-dichlorophenyl)sulfonyl]amino}-2-methyl-1-benzofuran-3-carboxylate, F0782-0124, pentyl 5-(2,5-dichlorophenylsulfonamido)-2-methylbenzofuran-3-carboxylate
| Molecular Formula | C21H21Cl2NO5S |
|---|---|
| Molecular Weight | 469.05 g/mol |
| LogP | 6.19582 |
| Topological Polar Surface Area | 85.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 469.05176 |
| Heavy Atoms | 30 |
| Complexity | 1187.5701 |
Chemical Identifiers
| CAS Number | 477487-68-6 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)Cl)Cl)C |
Product Overview
AQ-390/41640446 (CAS 477487-68-6), with molecular formula C21H21Cl2NO5S and molecular weight 469.05 g/mol. IUPAC: pentyl 5-[(2,5-dichlorophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of AQ-390/41640446
Property Insights of AQ-390/41640446
The XLogP value of 6.19582 indicates that AQ-390/41640446 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-390/41640446. Following Lipinski's Rule of Five, AQ-390/41640446 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-390/41640446?
The CAS number of AQ-390/41640446 is 477487-68-6.
What is the molecular formula of AQ-390/41640446?
The molecular formula of AQ-390/41640446 is C21H21Cl2NO5S.
What is the molecular weight of AQ-390/41640446?
The molecular weight of AQ-390/41640446 is 469.05 g/mol.
Where can I buy AQ-390/41640446?
You can request a quote for AQ-390/41640446 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-390/41640446?
Yes, KEHONG BIO provides custom synthesis services for AQ-390/41640446 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.