Thioxothiazolidinone derivative, 14
TL;DR: Thioxothiazolidinone derivative, 14 (CAS 1198159-45-3) is a chemical compound with molecular formula C17H12ClNO3S2 and molecular weight 376.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-3-(3-chlorophenyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: Thioxothiazolidinone derivative, 14, BIM-0019032.P001, (5Z)-3-(3-chlorophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one, (Z)-3-(3-chlorophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxothiazolidin-4-one, 3-(3-chlorophenyl)-5-(4-hydroxy-3-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C17H12ClNO3S2 |
|---|---|
| Molecular Weight | 376.99 g/mol |
| LogP | 4.46 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.99472 |
| Heavy Atoms | 24 |
| Complexity | 866.6642 |
Chemical Identifiers
| CAS Number | 1198159-45-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)C3=CC(=CC=C3)Cl)O |
Product Overview
Thioxothiazolidinone derivative, 14 (CAS 1198159-45-3), with molecular formula C17H12ClNO3S2 and molecular weight 376.99 g/mol. IUPAC: (5Z)-3-(3-chlorophenyl)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of Thioxothiazolidinone derivative, 14
Property Insights of Thioxothiazolidinone derivative, 14
The XLogP value of 4.46 indicates that Thioxothiazolidinone derivative, 14 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, Thioxothiazolidinone derivative, 14 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thioxothiazolidinone derivative, 14 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 Thioxothiazolidinone derivative, 14?
The CAS number of Thioxothiazolidinone derivative, 14 is 1198159-45-3.
What is the molecular formula of Thioxothiazolidinone derivative, 14?
The molecular formula of Thioxothiazolidinone derivative, 14 is C17H12ClNO3S2.
What is the molecular weight of Thioxothiazolidinone derivative, 14?
The molecular weight of Thioxothiazolidinone derivative, 14 is 376.99 g/mol.
Where can I buy Thioxothiazolidinone derivative, 14?
You can request a quote for Thioxothiazolidinone derivative, 14 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioxothiazolidinone derivative, 14?
Yes, KEHONG BIO provides custom synthesis services for Thioxothiazolidinone derivative, 14 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.