BAS 00520805
TL;DR: BAS 00520805 (CAS 331736-59-5) is a chemical compound with molecular formula C16H9ClFNOS2 and molecular weight 348.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-chlorophenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00520805, (5Z)-3-(3-chlorophenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, 3-(3-chlorophenyl)-5-(4-fluorobenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (Z)-3-(3-chlorophenyl)-5-(4-fluorobenzylidene)-2-thioxothiazolidin-4-one, 3-(3-Chloro-phenyl)-5-(4-fluoro-benzylidene)-2-thioxo-thiazolidin-4-one
| Molecular Formula | C16H9ClFNOS2 |
|---|---|
| Molecular Weight | 348.98 g/mol |
| LogP | 4.8849 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.9798 |
| Heavy Atoms | 22 |
| Complexity | 788.98773 |
Chemical Identifiers
| CAS Number | 331736-59-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N2C(=O)/C(=C/C3=CC=C(C=C3)F)/SC2=S |
Product Overview
BAS 00520805 (CAS 331736-59-5), with molecular formula C16H9ClFNOS2 and molecular weight 348.98 g/mol. IUPAC: (5Z)-3-(3-chlorophenyl)-5-[(4-fluorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00520805
Property Insights of BAS 00520805
The XLogP value of 4.8849 indicates that BAS 00520805 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, BAS 00520805 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00520805 has 0 hydrogen bond donor(s) and 3 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 BAS 00520805?
The CAS number of BAS 00520805 is 331736-59-5.
What is the molecular formula of BAS 00520805?
The molecular formula of BAS 00520805 is C16H9ClFNOS2.
What is the molecular weight of BAS 00520805?
The molecular weight of BAS 00520805 is 348.98 g/mol.
Where can I buy BAS 00520805?
You can request a quote for BAS 00520805 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00520805?
Yes, KEHONG BIO provides custom synthesis services for BAS 00520805 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.