Rhodanine, 5-methyl-3-(p-tolyl)-
TL;DR: Rhodanine, 5-methyl-3-(p-tolyl)- (CAS 2044-91-9) is a chemical compound with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: 5-Methyl-3-(p-tolyl)rhodanine, Rhodanine, 5-methyl-3-(p-tolyl)-, 4-Thiazolidinone, 5-methyl-3-(4-methylphenyl)-2-thioxo-, 5-methyl-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-methyl-3-(4-methylphenyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C11H11NOS2 |
|---|---|
| Molecular Weight | 237.03 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 237.02821 |
| Heavy Atoms | 15 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 2044-91-9 |
|---|---|
| SMILES | CC1C(=O)N(C(=S)S1)C2=CC=C(C=C2)C |
| InChIKey | JPTVQZSYOCWMFU-UHFFFAOYSA-N |
Product Overview
Rhodanine, 5-methyl-3-(p-tolyl)- (CAS 2044-91-9), with molecular formula C11H11NOS2 and molecular weight 237.03 g/mol. IUPAC: 5-methyl-3-(4-methylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of Rhodanine, 5-methyl-3-(p-tolyl)-
Property Insights of Rhodanine, 5-methyl-3-(p-tolyl)-
The XLogP value of 3.2 indicates that Rhodanine, 5-methyl-3-(p-tolyl)- 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 Rhodanine, 5-methyl-3-(p-tolyl)-. Following Lipinski's Rule of Five, Rhodanine, 5-methyl-3-(p-tolyl)- 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 Rhodanine, 5-methyl-3-(p-tolyl)-?
The CAS number of Rhodanine, 5-methyl-3-(p-tolyl)- is 2044-91-9.
What is the molecular formula of Rhodanine, 5-methyl-3-(p-tolyl)-?
The molecular formula of Rhodanine, 5-methyl-3-(p-tolyl)- is C11H11NOS2.
What is the molecular weight of Rhodanine, 5-methyl-3-(p-tolyl)-?
The molecular weight of Rhodanine, 5-methyl-3-(p-tolyl)- is 237.03 g/mol.
Where can I buy Rhodanine, 5-methyl-3-(p-tolyl)-?
You can request a quote for Rhodanine, 5-methyl-3-(p-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rhodanine, 5-methyl-3-(p-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Rhodanine, 5-methyl-3-(p-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.