Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)
TL;DR: Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) (CAS 41426-11-3) is a chemical compound with molecular formula C17H21NO4S3 and molecular weight 399.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-2-ethylsulfanylbenzo[e][1,3]benzothiazol-1-ium;ethyl sulfate
Also Known As: Naphtho(1,2-d)thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate, Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate, Ethyl 1-ethyl-2-(ethylthio)naphtho(1,2-d)thiazolium sulphate, Naphtho(1,2-d)thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1), Ethyl 1-ethyl-2-(ethylthio)naphtho[1,2-d]thiazolium sulphate
| Molecular Formula | C17H21NO4S3 |
|---|---|
| Molecular Weight | 399.06 g/mol |
| LogP | 3.957 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.06326 |
| Heavy Atoms | 25 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 41426-11-3 |
|---|---|
| SMILES | CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)SCC.CCOS(=O)(=O)[O-] |
| InChIKey | IFWXWPGIVCIFJW-UHFFFAOYSA-M |
Product Overview
Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) (CAS 41426-11-3), with molecular formula C17H21NO4S3 and molecular weight 399.06 g/mol. IUPAC: 1-ethyl-2-ethylsulfanylbenzo[e][1,3]benzothiazol-1-ium;ethyl sulfate.
Chemical Property Profile of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)
Property Insights of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)
The XLogP value of 3.957 indicates that Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1). Following Lipinski's Rule of Five, Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) has 0 hydrogen bond donor(s) and 6 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-(ethylthio)-, ethyl sulfate (1:1)?
The CAS number of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) is 41426-11-3.
What is the molecular formula of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)?
The molecular formula of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) is C17H21NO4S3.
What is the molecular weight of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)?
The molecular weight of Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) is 399.06 g/mol.
Where can I buy Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1)?
You can request a quote for Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (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-(ethylthio)-, ethyl sulfate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Naphtho[1,2-d]thiazolium, 1-ethyl-2-(ethylthio)-, ethyl sulfate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.