AO-022/42100648
TL;DR: AO-022/42100648 (CAS 615274-91-4) 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)-5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
Also Known As: AO-022/42100648, 5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-(4-ethoxybenzoyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one, 5-(2,3-dimethoxyphenyl)-1-(4,5-dimethylthiazol-2-yl)-4-(4-ethoxybenzoyl)-3-hydroxy-1H-pyrrol-2(5H)-one, (4E)-5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione, (4E)-5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C26H26N2O6S |
|---|---|
| Molecular Weight | 494.15 g/mol |
| LogP | 4.80214 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.15115 |
| Heavy Atoms | 35 |
| Complexity | 1292.3762 |
Chemical Identifiers
| CAS Number | 615274-91-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C)C)C4=C(C(=CC=C4)OC)OC)/O |
Product Overview
AO-022/42100648 (CAS 615274-91-4), with molecular formula C26H26N2O6S and molecular weight 494.15 g/mol. IUPAC: (4E)-5-(2,3-dimethoxyphenyl)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-4-[(4-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/42100648
Property Insights of AO-022/42100648
The XLogP value of 4.80214 indicates that AO-022/42100648 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42100648. Following Lipinski's Rule of Five, AO-022/42100648 has 1 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-022/42100648?
The CAS number of AO-022/42100648 is 615274-91-4.
What is the molecular formula of AO-022/42100648?
The molecular formula of AO-022/42100648 is C26H26N2O6S.
What is the molecular weight of AO-022/42100648?
The molecular weight of AO-022/42100648 is 494.15 g/mol.
Where can I buy AO-022/42100648?
You can request a quote for AO-022/42100648 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42100648?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42100648 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.