AN-988/40680230
TL;DR: AN-988/40680230 (CAS 428503-76-8) is a chemical compound with molecular formula C20H17BrFNO4S and molecular weight 465.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
Also Known As: AN-988/40680230, (5Z)-5-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione, 5-(2-bromo-5-ethoxy-4-methoxybenzylidene)-3-(4-fluorobenzyl)-1,3-thiazolidine-2,4-dione, (5Z)-5-(2-bromo-5-ethoxy-4-methoxybenzylidene)-3-(4-fluorobenzyl)-1,3-thiazolidine-2,4-dione
| Molecular Formula | C20H17BrFNO4S |
|---|---|
| Molecular Weight | 465.00 g/mol |
| LogP | 5.232 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.00458 |
| Heavy Atoms | 28 |
| Complexity | 945.96704 |
Chemical Identifiers
| CAS Number | 428503-76-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C(=C1)/C=C\2/C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F)Br)OC |
Product Overview
AN-988/40680230 (CAS 428503-76-8), with molecular formula C20H17BrFNO4S and molecular weight 465.00 g/mol. IUPAC: (5Z)-5-[(2-bromo-5-ethoxy-4-methoxyphenyl)methylidene]-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of AN-988/40680230
Property Insights of AN-988/40680230
The XLogP value of 5.232 indicates that AN-988/40680230 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, AN-988/40680230 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AN-988/40680230 has 0 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 AN-988/40680230?
The CAS number of AN-988/40680230 is 428503-76-8.
What is the molecular formula of AN-988/40680230?
The molecular formula of AN-988/40680230 is C20H17BrFNO4S.
What is the molecular weight of AN-988/40680230?
The molecular weight of AN-988/40680230 is 465.00 g/mol.
Where can I buy AN-988/40680230?
You can request a quote for AN-988/40680230 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-988/40680230?
Yes, KEHONG BIO provides custom synthesis services for AN-988/40680230 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.