3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene
TL;DR: 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene (CAS 342013-59-6) is a chemical compound with molecular formula C16H15NO2S2 and molecular weight 317.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3-methoxyphenoxy)ethylsulfanyl]-1,3-benzothiazole
Also Known As: TimTec1_002383, 3-(2-benzothiazol-2-ylthioethoxy)-1-methoxybenzene, 2-[2-(3-methoxyphenoxy)ethylsulfanyl]-1,3-benzothiazole, AR-422/13390045, 2-{[2-(3-methoxyphenoxy)ethyl]sulfanyl}-1,3-benzothiazole
| Molecular Formula | C16H15NO2S2 |
|---|---|
| Molecular Weight | 317.05 g/mol |
| LogP | 4.476 |
| Topological Polar Surface Area | 31.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.0544 |
| Heavy Atoms | 21 |
| Complexity | 693.87866 |
Chemical Identifiers
| CAS Number | 342013-59-6 |
|---|---|
| SMILES | COC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3S2 |
Product Overview
3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene (CAS 342013-59-6), with molecular formula C16H15NO2S2 and molecular weight 317.05 g/mol. IUPAC: 2-[2-(3-methoxyphenoxy)ethylsulfanyl]-1,3-benzothiazole.
Chemical Property Profile of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene
Property Insights of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene
The XLogP value of 4.476 indicates that 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.35 Ų, 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene has 0 hydrogen bond donor(s) and 5 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-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene?
The CAS number of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene is 342013-59-6.
What is the molecular formula of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene?
The molecular formula of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene is C16H15NO2S2.
What is the molecular weight of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene?
The molecular weight of 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene is 317.05 g/mol.
Where can I buy 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene?
You can request a quote for 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Benzothiazol-2-ylthioethoxy)-1-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.