3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium
TL;DR: 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium (CAS 53019-75-3) is a chemical compound with molecular formula C14H14NS+ and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethyl-2-methylbenzo[g][1,3]benzothiazol-3-ium
Also Known As: 2-Methyl-3-ethylnaphtho[2,1-d]thiazole-3-ium, 3-Ethyl-2-methylnaphtho[2,1-d]thiazol-3-ium, 3-ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium, 3-ethyl-2-methylbenzo[g][1,3]benzothiazol-3-ium
| Molecular Formula | C14H14NS+ |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.0847 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 53019-75-3 |
|---|---|
| SMILES | CC[N+]1=C(SC2=C1C=CC3=CC=CC=C32)C |
| InChIKey | RKKGTDYEFIQBEB-UHFFFAOYSA-N |
Product Overview
3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium (CAS 53019-75-3), with molecular formula C14H14NS+ and molecular weight 228.08 g/mol. IUPAC: 3-ethyl-2-methylbenzo[g][1,3]benzothiazol-3-ium.
Chemical Property Profile of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium
Property Insights of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium
The XLogP value of 4.5 indicates that 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.1 Ų, 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium has 0 hydrogen bond donor(s) and 1 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 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium?
The CAS number of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium is 53019-75-3.
What is the molecular formula of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium?
The molecular formula of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium is C14H14NS+.
What is the molecular weight of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium?
The molecular weight of 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium is 228.08 g/mol.
Where can I buy 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium?
You can request a quote for 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethyl-2-methylnaphtho[2,1-d][1,3]thiazol-3-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.