RefChem:538948
TL;DR: RefChem:538948 (CAS 618077-52-4) is a chemical compound with molecular formula C22H21NO5S2 and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(5Z)-5-[[5-(4-acetylphenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid
Also Known As: SALOR-INT L431265-1EA, 6-((5Z)-5-{[5-(4-ACETYLPHENYL)-2-FURYL]METHYLENE}-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL)HEXANOIC ACID, F1423-2729, 6-[(5Z)-5-{[5-(4-ACETYLPHENYL)FURAN-2-YL]METHYLIDENE}-4-OXO-2-SULFANYLIDENE-1,3-THIAZOLIDIN-3-YL]HEXANOIC ACID, 6-(5-((5-(4-Acetylphenyl)furan-2-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoic acid
| Molecular Formula | C22H21NO5S2 |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 4.9954 |
| Topological Polar Surface Area | 87.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 443.08612 |
| Heavy Atoms | 30 |
| Complexity | 1006.79016 |
Chemical Identifiers
| CAS Number | 618077-52-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C\3/C(=O)N(C(=S)S3)CCCCCC(=O)O |
Product Overview
RefChem:538948 (CAS 618077-52-4), with molecular formula C22H21NO5S2 and molecular weight 443.09 g/mol. IUPAC: 6-[(5Z)-5-[[5-(4-acetylphenyl)furan-2-yl]methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid.
Chemical Property Profile of RefChem:538948
Property Insights of RefChem:538948
The XLogP value of 4.9954 indicates that RefChem:538948 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.82 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:538948. Following Lipinski's Rule of Five, RefChem:538948 has 1 hydrogen bond donor(s) and 6 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 RefChem:538948?
The CAS number of RefChem:538948 is 618077-52-4.
What is the molecular formula of RefChem:538948?
The molecular formula of RefChem:538948 is C22H21NO5S2.
What is the molecular weight of RefChem:538948?
The molecular weight of RefChem:538948 is 443.09 g/mol.
Where can I buy RefChem:538948?
You can request a quote for RefChem:538948 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:538948?
Yes, KEHONG BIO provides custom synthesis services for RefChem:538948 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.