AE-641/12753124
TL;DR: AE-641/12753124 (CAS 302550-47-6) is a chemical compound with molecular formula C17H10ClFN2O2S2 and molecular weight 391.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
Also Known As: AE-641/12753124, N-[(5Z)-5-(2-chloro-6-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide, N-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide, (Z)-N-(5-(2-chloro-6-fluorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)benzamide, N-[5-(2-chloro-6-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C17H10ClFN2O2S2 |
|---|---|
| Molecular Weight | 391.99 g/mol |
| LogP | 4.0253 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.98563 |
| Heavy Atoms | 25 |
| Complexity | 882.5258 |
Chemical Identifiers
| CAS Number | 302550-47-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NN2C(=O)/C(=C/C3=C(C=CC=C3Cl)F)/SC2=S |
Product Overview
AE-641/12753124 (CAS 302550-47-6), with molecular formula C17H10ClFN2O2S2 and molecular weight 391.99 g/mol. IUPAC: N-[(5Z)-5-[(2-chloro-6-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide.
Chemical Property Profile of AE-641/12753124
Property Insights of AE-641/12753124
The XLogP value of 4.0253 indicates that AE-641/12753124 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, AE-641/12753124 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AE-641/12753124 has 1 hydrogen bond donor(s) and 4 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 AE-641/12753124?
The CAS number of AE-641/12753124 is 302550-47-6.
What is the molecular formula of AE-641/12753124?
The molecular formula of AE-641/12753124 is C17H10ClFN2O2S2.
What is the molecular weight of AE-641/12753124?
The molecular weight of AE-641/12753124 is 391.99 g/mol.
Where can I buy AE-641/12753124?
You can request a quote for AE-641/12753124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AE-641/12753124?
Yes, KEHONG BIO provides custom synthesis services for AE-641/12753124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.