AO-022/41649541
TL;DR: AO-022/41649541 (CAS 514192-30-4) is a chemical compound with molecular formula C25H19FN2O5S and molecular weight 478.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(2-fluorophenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one
Also Known As: AO-022/41649541, 1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(2-fluorophenyl)-3-hydroxy-4-(5-methyl-2-furoyl)-1,5-dihydro-2H-pyrrol-2-one, 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(2-fluorophenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one, (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-5-(2-fluorophenyl)-4-[hydroxy(5-methylfuran-2-yl)methylidene]pyrrolidine-2,3-dione, 1-(6-ethoxybenzo[d]thiazol-2-yl)-5-(2-fluorophenyl)-3-hydroxy-4-(5-methylfuran-2-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C25H19FN2O5S |
|---|---|
| Molecular Weight | 478.10 g/mol |
| LogP | 5.51842 |
| Topological Polar Surface Area | 92.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.09988 |
| Heavy Atoms | 34 |
| Complexity | 1471.0071 |
Chemical Identifiers
| CAS Number | 514192-30-4 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=C(O4)C)C5=CC=CC=C5F |
Product Overview
AO-022/41649541 (CAS 514192-30-4), with molecular formula C25H19FN2O5S and molecular weight 478.10 g/mol. IUPAC: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-2-(2-fluorophenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of AO-022/41649541
Property Insights of AO-022/41649541
The XLogP value of 5.51842 indicates that AO-022/41649541 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.87 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-022/41649541. Following Lipinski's Rule of Five, AO-022/41649541 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-022/41649541?
The CAS number of AO-022/41649541 is 514192-30-4.
What is the molecular formula of AO-022/41649541?
The molecular formula of AO-022/41649541 is C25H19FN2O5S.
What is the molecular weight of AO-022/41649541?
The molecular weight of AO-022/41649541 is 478.10 g/mol.
Where can I buy AO-022/41649541?
You can request a quote for AO-022/41649541 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-022/41649541?
Yes, KEHONG BIO provides custom synthesis services for AO-022/41649541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.