Lu 2443
TL;DR: Lu 2443 (CAS 22569-48-8) is a chemical compound with molecular formula C9H8N2S2 and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-5-phenyl-1,3,4-thiadiazol-4-ium-2-thiolate
Also Known As: Lu 2443, 4-methyl-5-phenyl-1,3,4-thiadiazol-4-ium-2-thiolate, 4-methyl-5-phenyl-2-thioxo-1,3,4-thiadiazol-4-ium-3-ide, 3-methyl-2-phenyl-1,3,4-thiadiazol-3-ium-5-thiolate, Didehydro-4-methyl-5-phenyl-1,3,4-thiadiazolidine-2-thione
| Molecular Formula | C9H8N2S2 |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 46.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.0129 |
| Heavy Atoms | 13 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 22569-48-8 |
|---|---|
| SMILES | C[N+]1=C(SC(=N1)[S-])C2=CC=CC=C2 |
| InChIKey | KKABNDWCHGAGAZ-UHFFFAOYSA-N |
Product Overview
Lu 2443 (CAS 22569-48-8), with molecular formula C9H8N2S2 and molecular weight 208.01 g/mol. IUPAC: 4-methyl-5-phenyl-1,3,4-thiadiazol-4-ium-2-thiolate.
Chemical Property Profile of Lu 2443
Property Insights of Lu 2443
The XLogP value of 3.2 indicates that Lu 2443 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.0 Ų, Lu 2443 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lu 2443 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 Lu 2443?
The CAS number of Lu 2443 is 22569-48-8.
What is the molecular formula of Lu 2443?
The molecular formula of Lu 2443 is C9H8N2S2.
What is the molecular weight of Lu 2443?
The molecular weight of Lu 2443 is 208.01 g/mol.
Where can I buy Lu 2443?
You can request a quote for Lu 2443 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lu 2443?
Yes, KEHONG BIO provides custom synthesis services for Lu 2443 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.