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Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)
TL;DR: Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) (CAS 71205-40-8) is a chemical compound with molecular formula C14H14INS and molecular weight 354.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-methylbenzo[e][1,3]benzothiazol-1-ium iodide
Also Known As: 1-Ethyl-2-methylnaphtho(1,2-d)thiazolium iodide, Naphtho(1,2-d)thiazolium, 1-ethyl-2-methyl-, iodide, Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide, Naphtho(1,2-d)thiazolium, 1-ethyl-2-methyl-, iodide (1:1), Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)
| Molecular Formula | C14H14INS |
|---|---|
| Molecular Weight | 354.99 g/mol |
| LogP | 0.67 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.98917 |
| Heavy Atoms | 17 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 71205-40-8 |
|---|---|
| SMILES | CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C.[I-] |
| InChIKey | IPKTZUFBDABYFP-UHFFFAOYSA-M |
Product Overview
Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) (CAS 71205-40-8), with molecular formula C14H14INS and molecular weight 354.99 g/mol. IUPAC: 1-ethyl-2-methylbenzo[e][1,3]benzothiazol-1-ium iodide.
Chemical Property Profile of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)
Property Insights of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)
The XLogP value of 0.67 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1). With a topological polar surface area (TPSA) of 32.1 Ų, Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) has 0 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 Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)?
The CAS number of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) is 71205-40-8.
What is the molecular formula of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)?
The molecular formula of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) is C14H14INS.
What is the molecular weight of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)?
The molecular weight of Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) is 354.99 g/mol.
Where can I buy Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)?
You can request a quote for Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[1,2-d]thiazolium, 1-ethyl-2-methyl-, iodide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.