RefChem:404555
TL;DR: RefChem:404555 (CAS 623935-52-4) is a chemical compound with molecular formula C26H17ClFN3OS2 and molecular weight 505.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-[(2-chlorophenyl)methyl]-5-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: (5Z)-3-(2-CHLOROBENZYL)-5-{[3-(4-FLUOROPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]METHYLENE}-2-THIOXO-1,3-THIAZOLIDIN-4-ONE, 3-(2-Chlorobenzyl)-5-((3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-2-thioxothiazolidin-4-one, (5Z)-3-(2-Chlorobenzyl)-5-((3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-YL)methylene)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-(2-chlorobenzyl)-5-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one, (5Z)-3-[(2-chlorophenyl)methyl]-5-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C26H17ClFN3OS2 |
|---|---|
| Molecular Weight | 505.05 g/mol |
| LogP | 6.7332 |
| Topological Polar Surface Area | 38.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 505.04855 |
| Heavy Atoms | 34 |
| Complexity | 1417.7535 |
Chemical Identifiers
| CAS Number | 623935-52-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)F)/C=C\4/C(=O)N(C(=S)S4)CC5=CC=CC=C5Cl |
Product Overview
RefChem:404555 (CAS 623935-52-4), with molecular formula C26H17ClFN3OS2 and molecular weight 505.05 g/mol. IUPAC: (5Z)-3-[(2-chlorophenyl)methyl]-5-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:404555
Property Insights of RefChem:404555
The XLogP value of 6.7332 indicates that RefChem:404555 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.13 Ų, RefChem:404555 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:404555 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:404555?
The CAS number of RefChem:404555 is 623935-52-4.
What is the molecular formula of RefChem:404555?
The molecular formula of RefChem:404555 is C26H17ClFN3OS2.
What is the molecular weight of RefChem:404555?
The molecular weight of RefChem:404555 is 505.05 g/mol.
Where can I buy RefChem:404555?
You can request a quote for RefChem:404555 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:404555?
Yes, KEHONG BIO provides custom synthesis services for RefChem:404555 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.