AO-022/43452957
TL;DR: AO-022/43452957 (CAS 903863-53-6) is a chemical compound with molecular formula C22H25NO6 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-7-[(dimethylamino)methyl]-6-hydroxy-4-methyl-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-3-one
Also Known As: AO-022/43452957, (Z)-7-((dimethylamino)methyl)-6-hydroxy-4-methyl-2-(2,3,4-trimethoxybenzylidene)benzofuran-3(2H)-one, F3385-4053, (2Z)-7-[(dimethylamino)methyl]-6-hydroxy-4-methyl-2-[(2,3,4-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-3-one, (2Z)-7-[(DIMETHYLAMINO)METHYL]-6-HYDROXY-4-METHYL-2-[(2,3,4-TRIMETHOXYPHENYL)METHYLIDENE]-1-BENZOFURAN-3-ONE
| Molecular Formula | C22H25NO6 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 3.40422 |
| Topological Polar Surface Area | 77.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.16818 |
| Heavy Atoms | 29 |
| Complexity | 993.5275 |
Chemical Identifiers
| CAS Number | 903863-53-6 |
|---|---|
| SMILES | CC1=CC(=C(C2=C1C(=O)/C(=C/C3=C(C(=C(C=C3)OC)OC)OC)/O2)CN(C)C)O |
Product Overview
AO-022/43452957 (CAS 903863-53-6), with molecular formula C22H25NO6 and molecular weight 399.17 g/mol. IUPAC: (2Z)-7-[(dimethylamino)methyl]-6-hydroxy-4-methyl-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-3-one.
Chemical Property Profile of AO-022/43452957
Property Insights of AO-022/43452957
The XLogP value of 3.40422 indicates that AO-022/43452957 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.46 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43452957. Following Lipinski's Rule of Five, AO-022/43452957 has 1 hydrogen bond donor(s) and 7 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-022/43452957?
The CAS number of AO-022/43452957 is 903863-53-6.
What is the molecular formula of AO-022/43452957?
The molecular formula of AO-022/43452957 is C22H25NO6.
What is the molecular weight of AO-022/43452957?
The molecular weight of AO-022/43452957 is 399.17 g/mol.
Where can I buy AO-022/43452957?
You can request a quote for AO-022/43452957 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43452957?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43452957 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.