TL;DR: AO-022/42313743 (CAS 622794-21-2) is a chemical compound with molecular formula C26H21ClO7 and molecular weight 480.0976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-6-[2-(4-chlorophenyl)-2-oxoethoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-3-one
Also Known As: AO-022/42313743, (2Z)-6-[2-(4-chlorophenyl)-2-oxoethoxy]-2-[(2,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-3-one, 6-[2-(4-chlorophenyl)-2-oxoethoxy]-2-(2,4,5-trimethoxybenzylidene)-1-benzofuran-3(2H)-one, (Z)-6-(2-(4-chlorophenyl)-2-oxoethoxy)-2-(2,4,5-trimethoxybenzylidene)benzofuran-3(2H)-one, (2Z)-6-[2-(4-chlorophenyl)-2-oxoethoxy]-2-(2,4,5-trimethoxybenzylidene)-1-benzofuran-3(2H)-one
| Molecular Formula | C26H21ClO7 |
| Molecular Weight | 480.0976 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 480.0976 Da |
| Heavy Atoms | 34 |
| Complexity | 747.0 |
| SMILES | COC1=CC(=C(C=C1/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC(=O)C4=CC=C(C=C4)Cl)OC)OC |
| InChIKey | WQWBQGCJWLNNHF-GATIEOLUSA-N |
The XLogP value of 5.5 indicates that AO-022/42313743 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42313743. Following Lipinski's Rule of Five, AO-022/42313743 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of AO-022/42313743 is 622794-21-2.
The molecular formula of AO-022/42313743 is C26H21ClO7.
The molecular weight of AO-022/42313743 is 480.0976 g/mol.
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