5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone
TL;DR: 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone (CAS 26929-65-7) is a chemical compound with molecular formula C12H13NOS2 and molecular weight 251.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-Methyl-3-(alpha-methylbenzyl)rhodanine, Rhodanine, 5-methyl-3-(alpha-methylbenzyl)-, 1,4-Methanonaphthalene,1-bromo-1,4-dihydro, 5-methyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-methyl-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C12H13NOS2 |
|---|---|
| Molecular Weight | 251.04 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.04385 |
| Heavy Atoms | 16 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 26929-65-7 |
|---|---|
| SMILES | CC1C(=O)N(C(=S)S1)C(C)C2=CC=CC=C2 |
| InChIKey | QJZUHKFLFBSWMU-UHFFFAOYSA-N |
Product Overview
5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone (CAS 26929-65-7), with molecular formula C12H13NOS2 and molecular weight 251.04 g/mol. IUPAC: 5-methyl-3-(1-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone
Property Insights of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone
The XLogP value of 3.1 indicates that 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone. Following Lipinski's Rule of Five, 5-Methyl-3-(1-phenylethyl)-2-thioxo-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 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone?
The CAS number of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone is 26929-65-7.
What is the molecular formula of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone?
The molecular formula of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone is C12H13NOS2.
What is the molecular weight of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone?
The molecular weight of 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone is 251.04 g/mol.
Where can I buy 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone?
You can request a quote for 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-3-(1-phenylethyl)-2-thioxo-4-thiazolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.