![5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone structure](/static/products/4016/401604-08-8.webp)
5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone
TL;DR: 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone (CAS 401604-08-8) is a chemical compound with molecular formula C18H13ClFNO3S2 and molecular weight 409.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[3-[(2-chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone, 5-({3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-[[3-[(2-chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C18H13ClFNO3S2 |
|---|---|
| Molecular Weight | 409.00 g/mol |
| LogP | 4.5555 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.00095 |
| Heavy Atoms | 26 |
| Complexity | 897.0544 |
Chemical Identifiers
| CAS Number | 401604-08-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=C2C(=O)NC(=S)S2)OCC3=C(C=CC=C3Cl)F |
Product Overview
5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone (CAS 401604-08-8), with molecular formula C18H13ClFNO3S2 and molecular weight 409.00 g/mol. IUPAC: 5-[[3-[(2-chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone
Property Insights of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone
The XLogP value of 4.5555 indicates that 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone has 1 hydrogen bond donor(s) and 5 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-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone?
The CAS number of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone is 401604-08-8.
What is the molecular formula of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone?
The molecular formula of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone is C18H13ClFNO3S2.
What is the molecular weight of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone?
The molecular weight of 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone is 409.00 g/mol.
Where can I buy 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone?
You can request a quote for 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-[[3-[(2-Chloro-6-fluorophenyl)methoxy]-4-methoxyphenyl]methylene]-2-thioxo-4-thiazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.