AP-906/41649683
TL;DR: AP-906/41649683 (CAS 514191-95-8) is a chemical compound with molecular formula C25H20N2O5S2 and molecular weight 492.08 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)-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: AP-906/41649683, 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-hydroxy-5-(2-methoxyphenyl)-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one, (4E)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(thiophen-2-yl)methylidene]-5-(2-methoxyphenyl)pyrrolidine-2,3-dione, 1-(6-ethoxybenzo[d]thiazol-2-yl)-3-hydroxy-5-(2-methoxyphenyl)-4-(thiophene-2-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C25H20N2O5S2 |
|---|---|
| Molecular Weight | 492.08 g/mol |
| LogP | 5.548 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.08136 |
| Heavy Atoms | 34 |
| Complexity | 1424.3724 |
Chemical Identifiers
| CAS Number | 514191-95-8 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC=CC=C5OC |
Product Overview
AP-906/41649683 (CAS 514191-95-8), with molecular formula C25H20N2O5S2 and molecular weight 492.08 g/mol. IUPAC: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-hydroxy-2-(2-methoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of AP-906/41649683
Property Insights of AP-906/41649683
The XLogP value of 5.548 indicates that AP-906/41649683 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-906/41649683. Following Lipinski's Rule of Five, AP-906/41649683 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AP-906/41649683?
The CAS number of AP-906/41649683 is 514191-95-8.
What is the molecular formula of AP-906/41649683?
The molecular formula of AP-906/41649683 is C25H20N2O5S2.
What is the molecular weight of AP-906/41649683?
The molecular weight of AP-906/41649683 is 492.08 g/mol.
Where can I buy AP-906/41649683?
You can request a quote for AP-906/41649683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-906/41649683?
Yes, KEHONG BIO provides custom synthesis services for AP-906/41649683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.