AO-022/43453336
TL;DR: AO-022/43453336 (CAS 844663-67-8) is a chemical compound with molecular formula C29H27NO4 and molecular weight 453.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-benzyl-5-(4-ethylphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Also Known As: AO-022/43453336, 1-benzyl-5-(4-ethylphenyl)-3-hydroxy-4-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one, (4E)-1-benzyl-5-(4-ethylphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione, (4E)-1-benzyl-5-(4-ethylphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione, 1-benzyl-5-(4-ethylphenyl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C29H27NO4 |
|---|---|
| Molecular Weight | 453.19 g/mol |
| LogP | 5.1943 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 453.194 |
| Heavy Atoms | 34 |
| Complexity | 1277.2426 |
Chemical Identifiers
| CAS Number | 844663-67-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2CC5=CC=CC=C5 |
Product Overview
AO-022/43453336 (CAS 844663-67-8), with molecular formula C29H27NO4 and molecular weight 453.19 g/mol. IUPAC: (4E)-1-benzyl-5-(4-ethylphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/43453336
Property Insights of AO-022/43453336
The XLogP value of 5.1943 indicates that AO-022/43453336 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453336. Following Lipinski's Rule of Five, AO-022/43453336 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/43453336?
The CAS number of AO-022/43453336 is 844663-67-8.
What is the molecular formula of AO-022/43453336?
The molecular formula of AO-022/43453336 is C29H27NO4.
What is the molecular weight of AO-022/43453336?
The molecular weight of AO-022/43453336 is 453.19 g/mol.
Where can I buy AO-022/43453336?
You can request a quote for AO-022/43453336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453336?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.