Thionalide
TL;DR: Thionalide (CAS 93-42-5) is a chemical compound with molecular formula C12H11NOS and molecular weight 217.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-naphthalen-2-yl-2-sulfanylacetamide
Also Known As: Thionalide, Thiolanilide, Thionalid, 2-Mercapto-N-2-naphthylacetamide, N-2-Naphthyl-mercaptoacetamide
| Molecular Formula | C12H11NOS |
|---|---|
| Molecular Weight | 217.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 30.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.05614 |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 93-42-5 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)NC(=O)CS |
| InChIKey | SGMHGVVTMOGJMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thionalide (CAS 93-42-5), with molecular formula C12H11NOS and molecular weight 217.06 g/mol. IUPAC: N-naphthalen-2-yl-2-sulfanylacetamide.
Chemical Property Profile of Thionalide
Property Insights of Thionalide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thionalide. With a topological polar surface area (TPSA) of 30.1 Ų, Thionalide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thionalide has 2 hydrogen bond donor(s) and 2 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 Thionalide?
The CAS number of Thionalide is 93-42-5.
What is the molecular formula of Thionalide?
The molecular formula of Thionalide is C12H11NOS.
What is the molecular weight of Thionalide?
The molecular weight of Thionalide is 217.06 g/mol.
Where can I buy Thionalide?
You can request a quote for Thionalide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thionalide?
Yes, KEHONG BIO provides custom synthesis services for Thionalide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.