RefChem:1071671
TL;DR: RefChem:1071671 (CAS 89752-49-8) is a chemical compound with molecular formula C17H13ClN2O2S2 and molecular weight 376.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-[(4-chloroanilino)methyl]-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-(((p-Chlorophenyl)amino)methyl)-5-((4-hydroxyphenyl)methylene)-2-thioxo-4-thiazolidinone, 4-Thiazolidinone, 3-(((4-chlorophenyl)amino)methyl)-5-((4-hydroxyphenyl)methylene)-2-thioxo-, (5E)-3-[(4-chloroanilino)methyl]-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, RefChem:1071671
| Molecular Formula | C17H13ClN2O2S2 |
|---|---|
| Molecular Weight | 376.01 g/mol |
| LogP | 4.3164 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 376.0107 |
| Heavy Atoms | 24 |
| Complexity | 804.3452 |
Chemical Identifiers
| CAS Number | 89752-49-8 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=C/2\C(=O)N(C(=S)S2)CNC3=CC=C(C=C3)Cl)O |
Product Overview
RefChem:1071671 (CAS 89752-49-8), with molecular formula C17H13ClN2O2S2 and molecular weight 376.01 g/mol. IUPAC: (5E)-3-[(4-chloroanilino)methyl]-5-[(4-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of RefChem:1071671
Property Insights of RefChem:1071671
The XLogP value of 4.3164 indicates that RefChem:1071671 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.57 Ų, RefChem:1071671 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1071671 has 2 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 RefChem:1071671?
The CAS number of RefChem:1071671 is 89752-49-8.
What is the molecular formula of RefChem:1071671?
The molecular formula of RefChem:1071671 is C17H13ClN2O2S2.
What is the molecular weight of RefChem:1071671?
The molecular weight of RefChem:1071671 is 376.01 g/mol.
Where can I buy RefChem:1071671?
You can request a quote for RefChem:1071671 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1071671?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1071671 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.