AN-698/40780644
TL;DR: AN-698/40780644 (CAS 496767-10-3) is a chemical compound with molecular formula C26H21FN2O4S and molecular weight 476.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide
Also Known As: AN-698/40780644, 2-(5-{4-[(4-fluorobenzyl)oxy]benzylidene}-2,4-dioxo-1,3-thiazolidin-3-yl)-N-(4-methylphenyl)acetamide, 2-[(5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide
| Molecular Formula | C26H21FN2O4S |
|---|---|
| Molecular Weight | 476.12 g/mol |
| LogP | 5.38812 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.1206 |
| Heavy Atoms | 34 |
| Complexity | 1239.3021 |
Chemical Identifiers
| CAS Number | 496767-10-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)F)/SC2=O |
Product Overview
AN-698/40780644 (CAS 496767-10-3), with molecular formula C26H21FN2O4S and molecular weight 476.12 g/mol. IUPAC: 2-[(5Z)-5-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]-N-(4-methylphenyl)acetamide.
Chemical Property Profile of AN-698/40780644
Property Insights of AN-698/40780644
The XLogP value of 5.38812 indicates that AN-698/40780644 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 AN-698/40780644. Following Lipinski's Rule of Five, AN-698/40780644 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 AN-698/40780644?
The CAS number of AN-698/40780644 is 496767-10-3.
What is the molecular formula of AN-698/40780644?
The molecular formula of AN-698/40780644 is C26H21FN2O4S.
What is the molecular weight of AN-698/40780644?
The molecular weight of AN-698/40780644 is 476.12 g/mol.
Where can I buy AN-698/40780644?
You can request a quote for AN-698/40780644 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/40780644?
Yes, KEHONG BIO provides custom synthesis services for AN-698/40780644 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.