AH-487/41139923
TL;DR: AH-487/41139923 (CAS 444779-63-9) is a chemical compound with molecular formula C18H21NO6S and molecular weight 379.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[4-[(E)-(3-butan-2-yl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy]acetate
Also Known As: AH-487/41139923, methyl (4-{(E)-[3-(butan-2-yl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)acetate, (E)-methyl 2-(4-((3-(sec-butyl)-2,4-dioxothiazolidin-5-ylidene)methyl)-2-methoxyphenoxy)acetate, methyl {4-[(3-sec-butyl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy}acetate, methyl 2-[4-[(E)-(3-butan-2-yl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy]acetate
| Molecular Formula | C18H21NO6S |
|---|---|
| Molecular Weight | 379.11 g/mol |
| LogP | 3.0818 |
| Topological Polar Surface Area | 82.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.10895 |
| Heavy Atoms | 26 |
| Complexity | 745.1969 |
Chemical Identifiers
| CAS Number | 444779-63-9 |
|---|---|
| SMILES | CCC(C)N1C(=O)/C(=C\C2=CC(=C(C=C2)OCC(=O)OC)OC)/SC1=O |
Product Overview
AH-487/41139923 (CAS 444779-63-9), with molecular formula C18H21NO6S and molecular weight 379.11 g/mol. IUPAC: methyl 2-[4-[(E)-(3-butan-2-yl-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenoxy]acetate.
Chemical Property Profile of AH-487/41139923
Property Insights of AH-487/41139923
The XLogP value of 3.0818 indicates that AH-487/41139923 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/41139923. Following Lipinski's Rule of Five, AH-487/41139923 has 0 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 AH-487/41139923?
The CAS number of AH-487/41139923 is 444779-63-9.
What is the molecular formula of AH-487/41139923?
The molecular formula of AH-487/41139923 is C18H21NO6S.
What is the molecular weight of AH-487/41139923?
The molecular weight of AH-487/41139923 is 379.11 g/mol.
Where can I buy AH-487/41139923?
You can request a quote for AH-487/41139923 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/41139923?
Yes, KEHONG BIO provides custom synthesis services for AH-487/41139923 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.