AO-022/43453071
TL;DR: AO-022/43453071 (CAS 578749-90-3) is a chemical compound with molecular formula C27H27FN2O6 and molecular weight 494.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-methoxy-4-pentoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione
Also Known As: AO-022/43453071, 4-(4-fluorobenzoyl)-3-hydroxy-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(5-methyl-3-isoxazolyl)-1,5-dihydro-2H-pyrrol-2-one, (4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-methoxy-4-pentoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione, (4E)-4-[(4-fluorophenyl)(hydroxy)methylidene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione, 4-(4-fluorobenzoyl)-3-hydroxy-5-(3-methoxy-4-(pentyloxy)phenyl)-1-(5-methylisoxazol-3-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C27H27FN2O6 |
|---|---|
| Molecular Weight | 494.19 g/mol |
| LogP | 5.32602 |
| Topological Polar Surface Area | 102.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.1853 |
| Heavy Atoms | 36 |
| Complexity | 1297.8477 |
Chemical Identifiers
| CAS Number | 578749-90-3 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C(=O)N2C4=NOC(=C4)C)OC |
Product Overview
AO-022/43453071 (CAS 578749-90-3), with molecular formula C27H27FN2O6 and molecular weight 494.19 g/mol. IUPAC: (4E)-4-[(4-fluorophenyl)-hydroxymethylidene]-5-(3-methoxy-4-pentoxyphenyl)-1-(5-methyl-1,2-oxazol-3-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of AO-022/43453071
Property Insights of AO-022/43453071
The XLogP value of 5.32602 indicates that AO-022/43453071 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/43453071. Following Lipinski's Rule of Five, AO-022/43453071 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-022/43453071?
The CAS number of AO-022/43453071 is 578749-90-3.
What is the molecular formula of AO-022/43453071?
The molecular formula of AO-022/43453071 is C27H27FN2O6.
What is the molecular weight of AO-022/43453071?
The molecular weight of AO-022/43453071 is 494.19 g/mol.
Where can I buy AO-022/43453071?
You can request a quote for AO-022/43453071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/43453071?
Yes, KEHONG BIO provides custom synthesis services for AO-022/43453071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.