AO-022/42399009
TL;DR: AO-022/42399009 (CAS 636988-48-2) is a chemical compound with molecular formula C24H22N2O5S and molecular weight 450.12 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-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: AO-022/42399009, 1-(4,5-dimethyl-1,3-thiazol-2-yl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]pyrrolidine-2,3-dione, (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione, 1-(4,5-dimethyl(1,3-thiazol-2-yl))-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-[ (4-methylphenyl)carbonyl]-3-pyrrolin-2-one
| Molecular Formula | C24H22N2O5S |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 4.40886 |
| Topological Polar Surface Area | 99.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.12494 |
| Heavy Atoms | 32 |
| Complexity | 1240.394 |
Chemical Identifiers
| CAS Number | 636988-48-2 |
|---|---|
| SMILES | CC1=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)OC)/O |
Product Overview
AO-022/42399009 (CAS 636988-48-2), with molecular formula C24H22N2O5S and molecular weight 450.12 g/mol. IUPAC: (4E)-1-(4,5-dimethyl-1,3-thiazol-2-yl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/42399009
Property Insights of AO-022/42399009
The XLogP value of 4.40886 indicates that AO-022/42399009 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/42399009. Following Lipinski's Rule of Five, AO-022/42399009 has 2 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-022/42399009?
The CAS number of AO-022/42399009 is 636988-48-2.
What is the molecular formula of AO-022/42399009?
The molecular formula of AO-022/42399009 is C24H22N2O5S.
What is the molecular weight of AO-022/42399009?
The molecular weight of AO-022/42399009 is 450.12 g/mol.
Where can I buy AO-022/42399009?
You can request a quote for AO-022/42399009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/42399009?
Yes, KEHONG BIO provides custom synthesis services for AO-022/42399009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.