5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
TL;DR: 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione (CAS 163777-83-1) is a chemical compound with molecular formula C17H12FNO2S and molecular weight 313.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
Also Known As: 5-benzylidene-3-(4-fluorobenzyl)-1,3-thiazolidine-2,4-dione, 5-benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
| Molecular Formula | C17H12FNO2S |
|---|---|
| Molecular Weight | 313.06 g/mol |
| LogP | 4.0622 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.05728 |
| Heavy Atoms | 22 |
| Complexity | 741.0141 |
Chemical Identifiers
| CAS Number | 163777-83-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)CC3=CC=C(C=C3)F |
Product Overview
5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione (CAS 163777-83-1), with molecular formula C17H12FNO2S and molecular weight 313.06 g/mol. IUPAC: 5-benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione.
Chemical Property Profile of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
Property Insights of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione
The XLogP value of 4.0622 indicates that 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione 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 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione?
The CAS number of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione is 163777-83-1.
What is the molecular formula of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione?
The molecular formula of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione is C17H12FNO2S.
What is the molecular weight of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione?
The molecular weight of 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione is 313.06 g/mol.
Where can I buy 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione?
You can request a quote for 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzylidene-3-[(4-fluorophenyl)methyl]-1,3-thiazolidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.