![6-Methylbenzo[D]thiazole-2-thiol structure](/static/products/226/2268-79-3.png)
6-Methylbenzo[D]thiazole-2-thiol
TL;DR: 6-Methylbenzo[D]thiazole-2-thiol (CAS 2268-79-3) is a chemical compound with molecular formula C8H7NS2 and molecular weight 181.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-3H-1,3-benzothiazole-2-thione
Also Known As: 6-METHYLBENZO[D]THIAZOLE-2-THIOL, 6-methyl-2-mercaptobenzothiazole, 2-Mercapto-6-methylbenzothiazole, 6-methyl-3H-1,3-benzothiazole-2-thione, 6-methyl-1,3-benzothiazole-2-thiol
| Molecular Formula | C8H7NS2 |
|---|---|
| Molecular Weight | 181.00 g/mol |
| LogP | 3.26731 |
| Topological Polar Surface Area | 15.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.002 |
| Heavy Atoms | 11 |
| Complexity | 438.53394 |
Chemical Identifiers
| CAS Number | 2268-79-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC(=S)S2 |
Product Overview
6-Methylbenzo[D]thiazole-2-thiol (CAS 2268-79-3), with molecular formula C8H7NS2 and molecular weight 181.00 g/mol. IUPAC: 6-methyl-3H-1,3-benzothiazole-2-thione.
Chemical Property Profile of 6-Methylbenzo[D]thiazole-2-thiol
Property Insights of 6-Methylbenzo[D]thiazole-2-thiol
The XLogP value of 3.26731 indicates that 6-Methylbenzo[D]thiazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.79 Ų, 6-Methylbenzo[D]thiazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methylbenzo[D]thiazole-2-thiol has 1 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 6-Methylbenzo[D]thiazole-2-thiol?
The CAS number of 6-Methylbenzo[D]thiazole-2-thiol is 2268-79-3.
What is the molecular formula of 6-Methylbenzo[D]thiazole-2-thiol?
The molecular formula of 6-Methylbenzo[D]thiazole-2-thiol is C8H7NS2.
What is the molecular weight of 6-Methylbenzo[D]thiazole-2-thiol?
The molecular weight of 6-Methylbenzo[D]thiazole-2-thiol is 181.00 g/mol.
Where can I buy 6-Methylbenzo[D]thiazole-2-thiol?
You can request a quote for 6-Methylbenzo[D]thiazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methylbenzo[D]thiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 6-Methylbenzo[D]thiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.