Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide
TL;DR: Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide (CAS 22261-67-2) is a chemical compound with molecular formula C13H16INOS and molecular weight 361.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-3-ium iodide
Also Known As: 2-(p-Anisyl)-3-ethyl-4-methylthiazolium iodide, 3-Ethyl-2-(p-methoxyphenyl)-4-methylthiazolium iodide, Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide, 3-ethyl-2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-3-ium iodide, (Z)-[(4Z)-4-(3-Ethyl-4-methyl-1,3-thiazol-2(3H)-ylidene)cyclohexa-2,5-dien-1-ylidene](methyl)oxidanium iodide
| Molecular Formula | C13H16INOS |
|---|---|
| Molecular Weight | 361.00 g/mol |
| LogP | 0.04352 |
| Topological Polar Surface Area | 41.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.99973 |
| Heavy Atoms | 17 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 22261-67-2 |
|---|---|
| SMILES | CC[N+]1=C(SC=C1C)C2=CC=C(C=C2)OC.[I-] |
| InChIKey | QVJDMKMGQINGKE-UHFFFAOYSA-M |
Product Overview
Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide (CAS 22261-67-2), with molecular formula C13H16INOS and molecular weight 361.00 g/mol. IUPAC: 3-ethyl-2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-3-ium iodide.
Chemical Property Profile of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide
Property Insights of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide
The XLogP value of 0.04352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide. With a topological polar surface area (TPSA) of 41.4 Ų, Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide 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 Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide?
The CAS number of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide is 22261-67-2.
What is the molecular formula of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide?
The molecular formula of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide is C13H16INOS.
What is the molecular weight of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide?
The molecular weight of Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide is 361.00 g/mol.
Where can I buy Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide?
You can request a quote for Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Thiazolium, 3-ethyl-2-(p-methoxyphenyl)-4-methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.