AO-022/42398509
TL;DR: AO-022/42398509 (CAS 579446-59-6) is a chemical compound with molecular formula C26H26N2O6S and molecular weight 494.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
Also Known As: AO-022/42398509, 1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(4-ethoxybenzoyl)-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one, (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione, (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione, 1-(4,5-dimethyl(1,3-thiazol-2-yl))-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyph enyl)carbonyl]-3-hydroxy-3-pyrrolin-2-one
| Molecular Formula | C26H26N2O6S |
|---|---|
| Molecular Weight | 494.15 g/mol |
| LogP | 4.88924 |
| Topological Polar Surface Area | 109.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.15115 |
| Heavy Atoms | 35 |
| Complexity | 1292.3762 |
Chemical Identifiers
| CAS Number | 579446-59-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C)C)C4=CC(=C(C=C4)O)OCC)/O |
Product Overview
AO-022/42398509 (CAS 579446-59-6), with molecular formula C26H26N2O6S and molecular weight 494.15 g/mol. IUPAC: (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/42398509
Property Insights of AO-022/42398509
The XLogP value of 4.88924 indicates that AO-022/42398509 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42398509. Following Lipinski's Rule of Five, AO-022/42398509 has 2 hydrogen bond donor(s) and 8 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-022/42398509?
The CAS number of AO-022/42398509 is 579446-59-6.
What is the molecular formula of AO-022/42398509?
The molecular formula of AO-022/42398509 is C26H26N2O6S.
What is the molecular weight of AO-022/42398509?
The molecular weight of AO-022/42398509 is 494.15 g/mol.
Where can I buy AO-022/42398509?
You can request a quote for AO-022/42398509 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42398509?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42398509 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.