3-Butyl-2-thio-4-thiazolidinone
TL;DR: 3-Butyl-2-thio-4-thiazolidinone (CAS 21494-64-4) is a chemical compound with molecular formula C7H11NOS2 and molecular weight 189.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 3-Butylrhodanine, Rhodanine, 3-butyl-, 3-Butyl-2-thioxothiazolidin-4-one, 3-Butyl-rhodanin, 3-butyl-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C7H11NOS2 |
|---|---|
| Molecular Weight | 189.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.02821 |
| Heavy Atoms | 11 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 21494-64-4 |
|---|---|
| SMILES | CCCCN1C(=O)CSC1=S |
| InChIKey | UTUUGODMVOQPEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Butyl-2-thio-4-thiazolidinone (CAS 21494-64-4), with molecular formula C7H11NOS2 and molecular weight 189.03 g/mol. IUPAC: 3-butyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 3-Butyl-2-thio-4-thiazolidinone
Property Insights of 3-Butyl-2-thio-4-thiazolidinone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Butyl-2-thio-4-thiazolidinone. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Butyl-2-thio-4-thiazolidinone. Following Lipinski's Rule of Five, 3-Butyl-2-thio-4-thiazolidinone has 0 hydrogen bond donor(s) and 3 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 3-Butyl-2-thio-4-thiazolidinone?
The CAS number of 3-Butyl-2-thio-4-thiazolidinone is 21494-64-4.
What is the molecular formula of 3-Butyl-2-thio-4-thiazolidinone?
The molecular formula of 3-Butyl-2-thio-4-thiazolidinone is C7H11NOS2.
What is the molecular weight of 3-Butyl-2-thio-4-thiazolidinone?
The molecular weight of 3-Butyl-2-thio-4-thiazolidinone is 189.03 g/mol.
Where can I buy 3-Butyl-2-thio-4-thiazolidinone?
You can request a quote for 3-Butyl-2-thio-4-thiazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butyl-2-thio-4-thiazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 3-Butyl-2-thio-4-thiazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.