AO-022/43453006
TL;DR: AO-022/43453006 (CAS 904499-86-1) is a chemical compound with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-2-(furan-2-ylmethylidene)-6-hydroxy-4-methyl-1-benzofuran-3-one
Also Known As: AO-022/43453006, (Z)-7-((4-ethylpiperazin-1-yl)methyl)-2-(furan-2-ylmethylene)-6-hydroxy-4-methylbenzofuran-3(2H)-one, F3385-4040, (2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-2-(furan-2-ylmethylidene)-6-hydroxy-4-methyl-1-benzofuran-3-one, (2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-2-[(furan-2-yl)methylidene]-6-hydroxy-4-methyl-2,3-dihydro-1-benzofuran-3-one
| Molecular Formula | C21H24N2O4 |
|---|---|
| Molecular Weight | 368.17 g/mol |
| LogP | 3.04732 |
| Topological Polar Surface Area | 66.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.1736 |
| Heavy Atoms | 27 |
| Complexity | 878.0817 |
Chemical Identifiers
| CAS Number | 904499-86-1 |
|---|---|
| SMILES | CCN1CCN(CC1)CC2=C(C=C(C3=C2O/C(=C\C4=CC=CO4)/C3=O)C)O |
Product Overview
AO-022/43453006 (CAS 904499-86-1), with molecular formula C21H24N2O4 and molecular weight 368.17 g/mol. IUPAC: (2Z)-7-[(4-ethylpiperazin-1-yl)methyl]-2-(furan-2-ylmethylidene)-6-hydroxy-4-methyl-1-benzofuran-3-one.
Chemical Property Profile of AO-022/43453006
Property Insights of AO-022/43453006
The XLogP value of 3.04732 indicates that AO-022/43453006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453006. Following Lipinski's Rule of Five, AO-022/43453006 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 AO-022/43453006?
The CAS number of AO-022/43453006 is 904499-86-1.
What is the molecular formula of AO-022/43453006?
The molecular formula of AO-022/43453006 is C21H24N2O4.
What is the molecular weight of AO-022/43453006?
The molecular weight of AO-022/43453006 is 368.17 g/mol.
Where can I buy AO-022/43453006?
You can request a quote for AO-022/43453006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453006?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.