AP-828/40969565
TL;DR: AP-828/40969565 (CAS 431918-28-4) is a chemical compound with molecular formula C26H30N2O4S and molecular weight 466.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-ethoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Also Known As: AP-828/40969565, N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-ethoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide, N-(3,4-dimethylphenyl)-2-[5-(4-ethoxy-5-isopropyl-2-methylbenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide, N-(3,4-dimethylphenyl)-2-(5-{[4-ethoxy-2-methyl-5-(methylethyl)phenyl]methylen e}-2,4-dioxo(1,3-thiazolidin-3-yl))acetamide, N-(3,4-dimethylphenyl)-2-{(5E)-5-[4-ethoxy-2-methyl-5-(propan-2-yl)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetamide
| Molecular Formula | C26H30N2O4S |
|---|---|
| Molecular Weight | 466.19 g/mol |
| LogP | 5.80896 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 466.19263 |
| Heavy Atoms | 33 |
| Complexity | 1137.352 |
Chemical Identifiers
| CAS Number | 431918-28-4 |
|---|---|
| SMILES | CCOC1=C(C=C(C(=C1)C)/C=C/2\C(=O)N(C(=O)S2)CC(=O)NC3=CC(=C(C=C3)C)C)C(C)C |
Product Overview
AP-828/40969565 (CAS 431918-28-4), with molecular formula C26H30N2O4S and molecular weight 466.19 g/mol. IUPAC: N-(3,4-dimethylphenyl)-2-[(5E)-5-[(4-ethoxy-2-methyl-5-propan-2-ylphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of AP-828/40969565
Property Insights of AP-828/40969565
The XLogP value of 5.80896 indicates that AP-828/40969565 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-828/40969565. Following Lipinski's Rule of Five, AP-828/40969565 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AP-828/40969565?
The CAS number of AP-828/40969565 is 431918-28-4.
What is the molecular formula of AP-828/40969565?
The molecular formula of AP-828/40969565 is C26H30N2O4S.
What is the molecular weight of AP-828/40969565?
The molecular weight of AP-828/40969565 is 466.19 g/mol.
Where can I buy AP-828/40969565?
You can request a quote for AP-828/40969565 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-828/40969565?
Yes, KEHONG BIO provides custom synthesis services for AP-828/40969565 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.